2-(2-chloro-6-methylanilino)pyridine-3-carbonitrile

C13H10ClN3 — CID 66256473

IUPAC2-(2-chloro-6-methylanilino)pyridine-3-carbonitrile
SMILESCc1cccc(Cl)c1Nc1ncccc1C#N
InChIInChI=1S/C13H10ClN3/c1-9-4-2-6-11(14)12(9)17-13-10(8-15)5-3-7-16-13/h2-7H,1H3,(H,16,17)
InChIKeyKVESFRKOZCJPCI-UHFFFAOYSA-N
MW243.70 g/mol
LogP3.66
Rot. Bonds2

About 2-(2-chloro-6-methylanilino)pyridine-3-carbonitrile

2-(2-chloro-6-methylanilino)pyridine-3-carbonitrile (PubChem CID 66256473) has the molecular formula C13H10ClN3 and a molecular weight of 243.70 g/mol. Its IUPAC name is 2-(2-chloro-6-methylanilino)pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-(2-chloro-6-methylanilino)pyridine-3-carbonitrile
PubChem CID66256473
Molecular FormulaC13H10ClN3
Molecular Weight243.70 g/mol
Exact Mass243.06
IUPAC Name2-(2-chloro-6-methylanilino)pyridine-3-carbonitrile
SMILESCc1cccc(Cl)c1Nc1ncccc1C#N
InChIInChI=1S/C13H10ClN3/c1-9-4-2-6-11(14)12(9)17-13-10(8-15)5-3-7-16-13/h2-7H,1H3,(H,16,17)
InChIKeyKVESFRKOZCJPCI-UHFFFAOYSA-N
XLogP3.66
TPSA48.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.70
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(2-chloro-6-methylanilino)pyridine-3-carbonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2,6-dibromoanilino)pyridine-3-carbonitrile
CID 107600351
2-(2-chloro-6-methylanilino)quinoline-3-carbonitrile
CID 66255713
2-[(5,7-dichloro-2,1,3-benzothiadiazol-4-yl)amino]pyridine-3-carbonitrile
CID 65474165
3-chloro-2-(2-ethyl-6-methylanilino)pyridine-4-carbonitrile
CID 107056671
3-(2,6-dichloroanilino)pyrazine-2-carbonitrile
CID 65467092
2-(3-chloro-4-fluoroanilino)pyridine-3-carbonitrile
CID 28832788
2-[(5-chloroquinolin-8-yl)amino]pyridine-3-carbonitrile
CID 116784510
2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]pyridine-3-carbonitrile
CID 31585319
2-chloro-N-(2-chloro-6-methylphenyl)-5-methylpyrimidin-4-amine
CID 79073312
2-[(4,5-dichloro-1-methylpyrrol-2-yl)methylamino]pyridine-3-carbonitrile
CID 133380381
5-amino-2-(2,6-dichloroanilino)pyridine-3-carbonitrile
CID 65469093
2-(4,5-dimethoxy-2-methylanilino)pyridine-3-carbonitrile
CID 18194831

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-6-methylanilino)pyridine-3-carbonitrile?
The IUPAC name of 2-(2-chloro-6-methylanilino)pyridine-3-carbonitrile (CID 66256473) is 2-(2-chloro-6-methylanilino)pyridine-3-carbonitrile.
What is the SMILES notation for 2-(2-chloro-6-methylanilino)pyridine-3-carbonitrile?
The canonical SMILES for 2-(2-chloro-6-methylanilino)pyridine-3-carbonitrile is Cc1cccc(Cl)c1Nc1ncccc1C#N.
What is the InChIKey of 2-(2-chloro-6-methylanilino)pyridine-3-carbonitrile?
The InChIKey is KVESFRKOZCJPCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10ClN3/c1-9-4-2-6-11(14)12(9)17-13-10(8-15)5-3-7-16-13/h2-7H,1H3,(H,16,17).
What are the key properties of 2-(2-chloro-6-methylanilino)pyridine-3-carbonitrile?
2-(2-chloro-6-methylanilino)pyridine-3-carbonitrile has a molecular weight of 243.70 g/mol, XLogP of 3.66, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-6-methylanilino)pyridine-3-carbonitrile is sourced from PubChem (CID 66256473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).