N-(5-cyano-2-methylphenyl)-3-methoxypyridine-4-carboxamide

C15H13N3O2 — CID 105063446

IUPACN-(5-cyano-2-methylphenyl)-3-methoxypyridine-4-carboxamide
SMILESCOc1cnccc1C(=O)Nc1cc(C#N)ccc1C
InChIInChI=1S/C15H13N3O2/c1-10-3-4-11(8-16)7-13(10)18-15(19)12-5-6-17-9-14(12)20-2/h3-7,9H,1-2H3,(H,18,19)
InChIKeySWZVHWWDXYPXDG-UHFFFAOYSA-N
MW267.29 g/mol
LogP2.52
Rot. Bonds3

About N-(5-cyano-2-methylphenyl)-3-methoxypyridine-4-carboxamide

N-(5-cyano-2-methylphenyl)-3-methoxypyridine-4-carboxamide (PubChem CID 105063446) has the molecular formula C15H13N3O2 and a molecular weight of 267.29 g/mol. Its IUPAC name is N-(5-cyano-2-methylphenyl)-3-methoxypyridine-4-carboxamide.

Molecular Properties

Compound NameN-(5-cyano-2-methylphenyl)-3-methoxypyridine-4-carboxamide
PubChem CID105063446
Molecular FormulaC15H13N3O2
Molecular Weight267.29 g/mol
Exact Mass267.10
IUPAC NameN-(5-cyano-2-methylphenyl)-3-methoxypyridine-4-carboxamide
SMILESCOc1cnccc1C(=O)Nc1cc(C#N)ccc1C
InChIInChI=1S/C15H13N3O2/c1-10-3-4-11(8-16)7-13(10)18-15(19)12-5-6-17-9-14(12)20-2/h3-7,9H,1-2H3,(H,18,19)
InChIKeySWZVHWWDXYPXDG-UHFFFAOYSA-N
XLogP2.52
TPSA75.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-chloro-N-(5-cyano-2-methylphenyl)-2-methoxybenzamide
CID 62059730
N-(5-cyano-2-pyridinyl)-3-methoxypyridine-4-carboxamide
CID 105063451
N-(5-cyano-2-methylphenyl)-2-methoxypyridine-3-carboxamide
CID 62060853
N-(5-cyano-2-methylphenyl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide
CID 105385118
N-(5-cyano-2-methoxyphenyl)pyridine-4-carboxamide
CID 49183025
4-[(3-methoxypyridine-4-carbonyl)amino]-3-methylbenzoic acid
CID 105063077
4-chloro-N-(5-cyano-2-methylphenyl)-6-methylpyridine-3-carboxamide
CID 81226761
methyl N-(5-cyano-2-methylphenyl)carbamate
CID 62065723
2-amino-5-chloro-N-(5-cyano-2-methylphenyl)pyridine-4-carboxamide
CID 114922463
N-(5-cyano-2-methylphenyl)-2,6-dimethylpyridine-3-carboxamide
CID 62059398
3-[(3-methoxypyridine-4-carbonyl)amino]-5-methyl-1H-pyrrole-2-carboxylic acid
CID 105063309
N-(5-cyano-2-methylphenyl)-2,3-dimethylbenzamide
CID 47475875

Frequently Asked Questions

What is the IUPAC name of N-(5-cyano-2-methylphenyl)-3-methoxypyridine-4-carboxamide?
The IUPAC name of N-(5-cyano-2-methylphenyl)-3-methoxypyridine-4-carboxamide (CID 105063446) is N-(5-cyano-2-methylphenyl)-3-methoxypyridine-4-carboxamide.
What is the SMILES notation for N-(5-cyano-2-methylphenyl)-3-methoxypyridine-4-carboxamide?
The canonical SMILES for N-(5-cyano-2-methylphenyl)-3-methoxypyridine-4-carboxamide is COc1cnccc1C(=O)Nc1cc(C#N)ccc1C.
What is the InChIKey of N-(5-cyano-2-methylphenyl)-3-methoxypyridine-4-carboxamide?
The InChIKey is SWZVHWWDXYPXDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2/c1-10-3-4-11(8-16)7-13(10)18-15(19)12-5-6-17-9-14(12)20-2/h3-7,9H,1-2H3,(H,18,19).
What are the key properties of N-(5-cyano-2-methylphenyl)-3-methoxypyridine-4-carboxamide?
N-(5-cyano-2-methylphenyl)-3-methoxypyridine-4-carboxamide has a molecular weight of 267.29 g/mol, XLogP of 2.52, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyano-2-methylphenyl)-3-methoxypyridine-4-carboxamide is sourced from PubChem (CID 105063446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).