6-amino-3-chloro-N-(2-cyanophenyl)pyridine-2-carboxamide

C13H9ClN4O — CID 62155906

IUPAC6-amino-3-chloro-N-(2-cyanophenyl)pyridine-2-carboxamide
SMILESN#Cc1ccccc1NC(=O)c1nc(N)ccc1Cl
InChIInChI=1S/C13H9ClN4O/c14-9-5-6-11(16)18-12(9)13(19)17-10-4-2-1-3-8(10)7-15/h1-6H,(H2,16,18)(H,17,19)
InChIKeyGRXCLQSRLHRLIF-UHFFFAOYSA-N
MW272.70 g/mol
LogP2.44
Rot. Bonds2

About 6-amino-3-chloro-N-(2-cyanophenyl)pyridine-2-carboxamide

6-amino-3-chloro-N-(2-cyanophenyl)pyridine-2-carboxamide (PubChem CID 62155906) has the molecular formula C13H9ClN4O and a molecular weight of 272.70 g/mol. Its IUPAC name is 6-amino-3-chloro-N-(2-cyanophenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-amino-3-chloro-N-(2-cyanophenyl)pyridine-2-carboxamide
PubChem CID62155906
Molecular FormulaC13H9ClN4O
Molecular Weight272.70 g/mol
Exact Mass272.05
IUPAC Name6-amino-3-chloro-N-(2-cyanophenyl)pyridine-2-carboxamide
SMILESN#Cc1ccccc1NC(=O)c1nc(N)ccc1Cl
InChIInChI=1S/C13H9ClN4O/c14-9-5-6-11(16)18-12(9)13(19)17-10-4-2-1-3-8(10)7-15/h1-6H,(H2,16,18)(H,17,19)
InChIKeyGRXCLQSRLHRLIF-UHFFFAOYSA-N
XLogP2.44
TPSA91.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.70
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-amino-N-(2-cyanophenyl)pyridazine-3-carboxamide
CID 55043296
3,4-dichloro-N-(2-cyanophenyl)benzamide
CID 798668
6-amino-3-chloro-N-(3-cyanophenyl)pyridine-2-carboxamide
CID 62156588
(2-cyanophenyl)urea
CID 13155570
4-chloro-N-(2-cyanophenyl)-1,2-thiazole-5-carboxamide
CID 150757890
5-N-(2-chlorophenyl)-3-N-(2-cyanophenyl)pyridine-3,5-dicarboxamide
CID 109108776
6-amino-3-chloro-N-methylpyridine-2-carboxamide
CID 62156050
6-bromo-N-(2-cyanophenyl)pyridine-2-carboxamide
CID 103889509
N-(2-cyanophenyl)quinoline-2-carboxamide
CID 10588311
N-(2-cyanophenyl)-2-(3,4-dichlorophenyl)-1,3-oxazole-4-carboxamide
CID 84552909
6-amino-3-chloro-N-(4-methylphenyl)pyridine-2-carboxamide
CID 55042017
N-(2-cyanophenyl)-4,5-dimethyl-1,2-oxazole-3-carboxamide
CID 110864656

Frequently Asked Questions

What is the IUPAC name of 6-amino-3-chloro-N-(2-cyanophenyl)pyridine-2-carboxamide?
The IUPAC name of 6-amino-3-chloro-N-(2-cyanophenyl)pyridine-2-carboxamide (CID 62155906) is 6-amino-3-chloro-N-(2-cyanophenyl)pyridine-2-carboxamide.
What is the SMILES notation for 6-amino-3-chloro-N-(2-cyanophenyl)pyridine-2-carboxamide?
The canonical SMILES for 6-amino-3-chloro-N-(2-cyanophenyl)pyridine-2-carboxamide is N#Cc1ccccc1NC(=O)c1nc(N)ccc1Cl.
What is the InChIKey of 6-amino-3-chloro-N-(2-cyanophenyl)pyridine-2-carboxamide?
The InChIKey is GRXCLQSRLHRLIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9ClN4O/c14-9-5-6-11(16)18-12(9)13(19)17-10-4-2-1-3-8(10)7-15/h1-6H,(H2,16,18)(H,17,19).
What are the key properties of 6-amino-3-chloro-N-(2-cyanophenyl)pyridine-2-carboxamide?
6-amino-3-chloro-N-(2-cyanophenyl)pyridine-2-carboxamide has a molecular weight of 272.70 g/mol, XLogP of 2.44, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-3-chloro-N-(2-cyanophenyl)pyridine-2-carboxamide is sourced from PubChem (CID 62155906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).