4-cyano-6-methyl-N-(2-methylphenyl)pyridine-2-carboxamide

C15H13N3O — CID 68787568

IUPAC4-cyano-6-methyl-N-(2-methylphenyl)pyridine-2-carboxamide
SMILESCc1cc(C#N)cc(C(=O)Nc2ccccc2C)n1
InChIInChI=1S/C15H13N3O/c1-10-5-3-4-6-13(10)18-15(19)14-8-12(9-16)7-11(2)17-14/h3-8H,1-2H3,(H,18,19)
InChIKeyJCJPRRBEGVHELQ-UHFFFAOYSA-N
MW251.29 g/mol
LogP2.82
Rot. Bonds2

About 4-cyano-6-methyl-N-(2-methylphenyl)pyridine-2-carboxamide

4-cyano-6-methyl-N-(2-methylphenyl)pyridine-2-carboxamide (PubChem CID 68787568) has the molecular formula C15H13N3O and a molecular weight of 251.29 g/mol. Its IUPAC name is 4-cyano-6-methyl-N-(2-methylphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-cyano-6-methyl-N-(2-methylphenyl)pyridine-2-carboxamide
PubChem CID68787568
Molecular FormulaC15H13N3O
Molecular Weight251.29 g/mol
Exact Mass251.11
IUPAC Name4-cyano-6-methyl-N-(2-methylphenyl)pyridine-2-carboxamide
SMILESCc1cc(C#N)cc(C(=O)Nc2ccccc2C)n1
InChIInChI=1S/C15H13N3O/c1-10-5-3-4-6-13(10)18-15(19)14-8-12(9-16)7-11(2)17-14/h3-8H,1-2H3,(H,18,19)
InChIKeyJCJPRRBEGVHELQ-UHFFFAOYSA-N
XLogP2.82
TPSA65.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4,6-dimethyl-N-(2-methylphenyl)pyridine-2-carboxamide
CID 19224338
4-cyano-6-methyl-N-(3-methylphenyl)pyridine-2-carboxamide
CID 46899355
2-hydrazinyl-6-methyl-N-(2-methylphenyl)pyrimidine-4-carboxamide
CID 114220571
2-(diethylamino)-6-methyl-N-(2-methylphenyl)pyrimidine-4-carboxamide
CID 109332221
N-(3-cyanophenyl)-2-methyl-6-(2-methylanilino)pyrimidine-4-carboxamide
CID 112848112
2-(2-cyanoanilino)-N-(2-cyanophenyl)-6-methylpyrimidine-4-carboxamide
CID 109338178
1-chloro-N-(2-methylphenyl)isoquinoline-3-carboxamide
CID 43342754
2-(4-cyanoanilino)-N-(2-fluorophenyl)-6-methylpyrimidine-4-carboxamide
CID 109336829
6-(tert-butylamino)-2-methyl-N-(2-methylphenyl)pyrimidine-4-carboxamide
CID 109373670
2-N-(2-cyanophenyl)-4-N-(2-methylphenyl)pyridine-2,4-dicarboxamide
CID 109091043
N-(2-chlorophenyl)-4,6-dimethylpyridine-2-carboxamide
CID 19224329
6-methyl-N-(2-methylphenyl)-2-(prop-2-enylamino)pyrimidine-4-carboxamide
CID 109320120

Frequently Asked Questions

What is the IUPAC name of 4-cyano-6-methyl-N-(2-methylphenyl)pyridine-2-carboxamide?
The IUPAC name of 4-cyano-6-methyl-N-(2-methylphenyl)pyridine-2-carboxamide (CID 68787568) is 4-cyano-6-methyl-N-(2-methylphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 4-cyano-6-methyl-N-(2-methylphenyl)pyridine-2-carboxamide?
The canonical SMILES for 4-cyano-6-methyl-N-(2-methylphenyl)pyridine-2-carboxamide is Cc1cc(C#N)cc(C(=O)Nc2ccccc2C)n1.
What is the InChIKey of 4-cyano-6-methyl-N-(2-methylphenyl)pyridine-2-carboxamide?
The InChIKey is JCJPRRBEGVHELQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O/c1-10-5-3-4-6-13(10)18-15(19)14-8-12(9-16)7-11(2)17-14/h3-8H,1-2H3,(H,18,19).
What are the key properties of 4-cyano-6-methyl-N-(2-methylphenyl)pyridine-2-carboxamide?
4-cyano-6-methyl-N-(2-methylphenyl)pyridine-2-carboxamide has a molecular weight of 251.29 g/mol, XLogP of 2.82, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyano-6-methyl-N-(2-methylphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 68787568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).