Browse
Submit Data
Databases
API
Help

Dataset Information

0 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

N-Cyclo-hexyl-N-ethyl-4-methyl-benzene-sulfonamide.

ABSTRACT: The title compound, C(15)H(23)NO(2)S, contains cyclo-hexyl and ethyl substituents on the sulfonamide N atom and the cyclo-hexyl ring adopts a classic chair conformation. The dihedral angle between the benzene ring plane and the mean plane through the six atoms of the cyclo-hexyl ring is 59.92?(6)°. In the crystal structure, C-H?O hydrogen bonds link mol-ecules into sheets extending in the bc plane.

SUBMITTER: Haider Z

PROVIDER: S-EPMC2980259 | biostudies-literature | 2009 Dec

REPOSITORIES: biostudies-literature

ACCESS DATA

Json Xml

Publications

N-Cyclo-hexyl-N-ethyl-4-methyl-benzene-sulfonamide.

Haider Zeeshan Z Arshad Muhammad Nadeem MN Simpson Jim J Khan Islam Ullah IU Shafiq Muhammad M

Acta crystallographica. Section E, Structure reports online 20091212 Pt 1

The title compound, C(15)H(23)NO(2)S, contains cyclo-hexyl and ethyl substituents on the sulfonamide N atom and the cyclo-hexyl ring adopts a classic chair conformation. The dihedral angle between the benzene ring plane and the mean plane through the six atoms of the cyclo-hexyl ring is 59.92 (6)°. In the crystal structure, C-H⋯O hydrogen bonds link mol-ecules into sheets extending in the bc plane. ...[more]

PMID: 21579993

Similar Datasets

N-Benzyl-N-cyclo-hexyl-4-methyl-benzene-sulfonamide.

Project description:In the title compound, C(20)H(25)NO(2)S, the cyclo-hexyl ring exists in a chair form and the mean plane through all six atoms makes dihedral angles of 56.12?(9) and 55.19?(10)° with the benzene and phenyl rings, respectively. The dihedral angle between the two aromatic rings is 77.23?(7)°. A weak intra-molecular C-H?O interaction occurs.

| S-EPMC2972048 | biostudies-literature

N-Cyclo-hexyl-N-ethyl-benzene-sulfonamide.

Project description:The title compound, C(14)H(21)NO(2)S, synthesized by N-methyl-ation of cyclo-hexyl-amine sulfonamide with ethyl iodide is of inter-est as a precursor to biologically active sulfur-containing heterocyclic compounds. There are two independent mol-ecules in the asymmetric unit. The dihedral angles between the mean planes of the phenyl ring and the cyclo-hexyl ring are 40.29?(11) and 37.91?(13)° in the two mol-ecules.

| S-EPMC2971250 | biostudies-other

A second monoclinic polymorph of N-cyclo-hexyl-N-ethyl-benzene-sulfonamide.

Project description:The crystal structure of the title compound, C(14)H(21)NO(2)S, is a polymorph of the structure reported by Khan et al. [Acta Cryst. (2009), E65, o2867] which is also monoclinic (space group P2(1)/c). The unit cell in the title structure is approximately half the volume of the previously reported polymorph and the asymmetric unit of the title compound contains one mol-ecule rather than two independent mol-ecules in the other polymorph. In the title mol-ecule, the cyclo-hexane ring is in the typical chair form. In the crystal structure, mol-ecules are linked via weak inter-molecular C-H?O inter-actions, forming a chain along the b-axis direction.

| S-EPMC2972150 | biostudies-literature

4-Bromo-N-cyclo-hexyl-benzene-sulfonamide.

Project description:The title compound, C(12)H(16)BrNO(2)S, adopts an L-shaped conformation with the central C-S-N-C torsion angle being -77.8?(3)°. The crystal packing features N-H?O hydrogen bonds, which lead to C(4) chains propagating in [010]; the second O atom is involved in short intra-molecular C-H?O contacts.

| S-EPMC3007228 | biostudies-literature

N-Cyclo-hexyl-N-propyl-benzene-sulfonamide.

Project description:The title compound, C(15)H(23)NO(2)S, synthesized by N-methyl-ation of cyclo-hexyl-amine sulfonamide with propyl iodide, is of inter-est as a precursor to biologically active sulfur-containing heterocyclic compounds. The cyclo-hexyl ring exists in the chair form and the dihedral angle between the ring plane of the benzene ring and that of the cyclo-hexyl ring is 50.13 (9)°.

| S-EPMC2971915 | biostudies-literature

2,5-Dichloro-N-cyclo-hexyl-benzene-sulfonamide.

Project description:The structure of the title sulfonamide, C(12)H(15)Cl(2)NO(2)S, features a distorted tetra-hedral geometry for the S atom [maximum deviation: O-S-O = 120.23 (14)°]. One of the sulfonamide O atoms is coplanar with the benzene ring [C-C-S-O torsion angle = -174.5 (2)°], whereas the other lies well above the plane [C-C-S-O = 57.0 (3)°]. A chair conformation is found for the cyclo-hexyl ring. In the crystal, supra-molecular chains aligned along the c axis are formed via N-H⋯O hydrogen bonds; these are consolidated in the three-dimensional packing by C-H⋯O contacts involving the second sulfonamide O atom.

| S-EPMC2983123 | biostudies-literature

2-(N-Cyclo-hexyl-carbamo-yl)benzene-sulfonamide.

Project description:The asymmetric unit of the title compound, C(13)H(18)N(2)O(3)S, contains two mol-ecules with similar conformations. In both mol-ecules, the cyclo-hexyl rings adopt chair conformations, with the attached N atom in an equatorial orientation and an intra-molecular N-H?O hydrogen bond generates an S(7) ring. In the crystal, N-H?O hydrogen bonds link the mol-ecules and a C-H?O hydrogen bond is also observed. The crystal studied was a racemic twin.

| S-EPMC3275049 | biostudies-literature

N-Cyclo-hexyl-4-meth-oxy-benzene-sulfonamide.

Project description:In the title mol-ecule, C(13)H(19)NO(3)S, the S atom has a distorted tetra-hedral geometry with an O-S-O bond angle of 120.39 (18)°. The cyclo-hexane ring has a chair conformation. In the crystal, mol-ecules are connected by inter-molecular N-H⋯O hydrogen bonds, forming zigzag hydrogen-bonded chains directed along the c axis.

| S-EPMC3099924 | biostudies-literature

N-Cyclo-hexyl-4-meth-yl-N-propyl-benzene-sulfonamide.

Project description:The title compound, C(16)H(25)NO(2)S, is a sulfonamide derivative with the substitution of propyl and cyclo-hexyl groups at the N atom. The least-squares plane through all six C atoms of the cyclo-hexyl ring forms a dihedral angle of 58.88?(12)° with the toluene ring. No hydrogen-bonding inter-actions are present in the crystal structure.

| S-EPMC2983795 | biostudies-literature

4-Chloro-N-cyclo-hexyl-benzene-sulfonamide.

Project description:The title compound, C(12)H(16)ClNO(2)S, adopts an L-shaped conformation, with the central C-S-N-C torsion angle being -78.0?(2)°. The cyclo-hexyl ring adopts a chair conformation. In the crystal, adjacent mol-ecules are connected by pairs of N-H?O hydrogen bonds around an inversion centre, forming cyclic dimers [graph set R(2) (2)(8)].

| S-EPMC3275220 | biostudies-other

OmicsDI is part of the ELIXIR infrastructure

OmicsDI is an Elixir interoperability service. Learn more ›

Tweets

OmicsDI Databases

PRIDE
PeptideAtlas
MassIVE
JPOST Repository
Physiome Model Repository

EGA
EVA
ENA
LINCS
PAXDB
Cell Collective

MetaboLights
Metabolomics Workbench
MetabolomeExpress
GNPS
BioModels
FAIRDOMHub

ArrayExpress
dbGaP
ExpressionAtlas
GEO
NODE

Information

Databases
Help
API
Contact us
Code on GitHub
Terms of use
Submit Data