Browse
Submit Data
Databases
API
Help

Dataset Information

21 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

3,5-Dichloro-6-methyl-pyridin-2-amine.

ABSTRACT: In the title compound, C(6)H(6)Cl(2)N(2), intra-molecular N-H?Cl and C-H?Cl contacts generate five-membered rings, producing S(5) ring motifs. Pairs of inter-molecular N-H?N hydrogen bonds link neighbouring mol-ecules into dimers with R(2) (2)(8) ring motifs. In the crystal structure, these dimers are connected by N-H?Cl inter-actions and are packed into columns.

SUBMITTER: Fun HK

PROVIDER: S-EPMC2968004 | biostudies-literature | 2008 Dec

REPOSITORIES: biostudies-literature

ACCESS DATA

Json Xml

Publications

3,5-Dichloro-6-methyl-pyridin-2-amine.

Fun Hoong-Kun HK Kia Reza R Maity Annada C AC Maity Sibaprasad S Goswami Shyamaprosad S

Acta crystallographica. Section E, Structure reports online 20081213 Pt 1

In the title compound, C(6)H(6)Cl(2)N(2), intra-molecular N-H⋯Cl and C-H⋯Cl contacts generate five-membered rings, producing S(5) ring motifs. Pairs of inter-molecular N-H⋯N hydrogen bonds link neighbouring mol-ecules into dimers with R(2) (2)(8) ring motifs. In the crystal structure, these dimers are connected by N-H⋯Cl inter-actions and are packed into columns. ...[more]

PMID: 21581735

Similar Datasets

5-[(3,5-Dichloro-anilino)meth-yl]-N-(3,5-dichloro-phen-yl)-6-methyl-2-phenyl-pyrimidin-4-amine.

Project description:In the title compound, C24H18Cl4N4, the pyrimidine ring makes dihedral angles of 19.1 (2), 4.1 (2) and 67.5 (2)°, respectively, with phenyl and two benzene rings, and the mol-ecular conformation is stabilized by an intra-molecular N-H⋯N hydrogen bond closing a six-membered ring with an S(6) motif. In the crystal, a pair of inter-molecular N-H⋯N hydrogen bonds connect two mol-ecules, forming inversion dimers with R2(2)(12) motifs. C-H⋯π inter-actions links the dimers into a chain running along the a-axis direction. There are also π-π stacking inter-actions [centroid-centroid distance = 3.666 (4) Å] between the benzene rings of adjacent chains.

| S-EPMC3588999 | biostudies-literature

6-Methyl-pyridin-2-amine.

Project description:In the title mol-ecule, C6H8N2, the endocyclic angles are in the range 118.43?(9)-122.65?(10)°. The mol-ecular skeleton is planar (r.m.s. deviation = 0.007?Å). One of the two amino H atoms is involved in an N-H?N hydrogen bond, forming an inversion dimer, while the other amino H atom participates in N-H?? inter-actions between the dimers, forming layers parallel to (100).

| S-EPMC3589040 | biostudies-literature

6-Methyl-pyridin-3-amine.

Project description:In the mol-ecule of the title compound, C(6)H(8)N(2), the methyl C and amine N atoms are 0.021?(2) and 0.058?(2)?Å from the pyridine ring plane. In the crystal structure, inter-molecular N-H?N hydrogen bonds link the mol-ecules.

| S-EPMC2968044 | biostudies-literature

3,5-Dichloro-phenyl 4-methyl-benzoate.

Project description:The structure of the title compound, C(14)H(10)Cl(2)O(2), resembles those of 3-chloro-phenyl 4-methyl-benzoate, 2,6-dichloro-phenyl 4-methyl-benzoate and 2,4-dichloro-phenyl 4-methyl-benzoate, with similar bond parameters. The dihedral angle between the benzene and benzoyl rings is 48.81 (6)°.

| S-EPMC2962169 | biostudies-literature

4-Methyl-3-nitro-pyridin-2-amine.

Project description:In the title compound, C(6)H(7)N(3)O(2), the dihedral angle between the nitro group and the pyridine ring is 15.5?(3)° and an intra-molecular N-H?O hydrogen bond occurs. In the crystal, inversion dimers linked by two N-H?N hydrogen bonds occur, resulting in R(2) (2)(8) rings. The packing is stabilized by aromatic ?-? stacking [centroid-centroid distance = 3.5666?(15)?Å] and a short N-O?? contact is seen.

| S-EPMC2969271 | biostudies-literature

Methyl 3-[(3,5-dichloro-anilino)carbon-yl]propionate.

Project description:In the title compound, C(11)H(11)Cl(2)NO(3), the amide O atom and the carbonyl O atom of the ester segment are anti to each other and anti to the H atoms of the adjacent -CH(2) groups. In the crystal structure, mol-ecules are packed into centrosymmetric dimers through inter-molecular N-H⋯O hydrogen bonds. The dimers are linked into a layer structure extending parallel to (02) by C-H⋯O hydrogen bonds.

| S-EPMC2979985 | biostudies-literature

Crystal structure of bis(3,5-dichloro-2-hydroxybenzyl)(2-methoxyethyl)amine

Project description: Not available

| S-EPMC10483550 | biostudies-literature

4-Methyl-N-(3-methyl-phen-yl)pyridin-2-amine.

Project description:The title amine, C(13)H(14)N(2), is twisted with a dihedral angle between the rings of 60.07?(9)°. The amine N-H group and pyridine N atom are syn allowing for the formation of centrosymmetric eight-membered {?HNCN}(2) synthons via N-H?N hydrogen bonds. The two-mol-ecule aggregates are sustained in the three-dimensional crystal packing via C-H?? and ?-? inter-actions [centroid-centroid distance for pyridyl rings = 3.7535?(12)?Å].

| S-EPMC3247467 | biostudies-literature

(3,6-Dichloro-pyridin-2-yl)(3,5-dimethyl-1H-pyrazol-1-yl)methanone.

Project description:In the crystal structure of the title compound, C(11)H(9)Cl(2)N(3)O, mol-ecules are held together by short inter-molecular Cl?Cl contacts [3.319?(1)?Å] and C-H?N hydrogen bonds, forming two-dimensional networks parallel to (01).

| S-EPMC2961666 | biostudies-literature

N-(3,5-Dichloro-phen-yl)-4-methyl-benzene-sulfonamide.

Project description:In the crystal structure of the title compound, C(13)H(11)Cl(2)NO(2)S, the conformation of the N-C bond in the C-SO(2)-NH-C segment is gauche with respect to the SO bonds. The two benzene rings are tilted by 79.6?(1)° relative to each other. In the crystal, inversion dimers linked by pairs of N-H?O hydrogen bonds occur.

| S-EPMC2970379 | biostudies-literature

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