2-(cyanomethyl)-5-(2-methoxyphenyl)pyridine-4-carboxamide

C15H13N3O2 — CID 155353624

IUPAC2-(cyanomethyl)-5-(2-methoxyphenyl)pyridine-4-carboxamide
SMILESCOc1ccccc1-c1cnc(CC#N)cc1C(N)=O
InChIInChI=1S/C15H13N3O2/c1-20-14-5-3-2-4-11(14)13-9-18-10(6-7-16)8-12(13)15(17)19/h2-5,8-9H,6H2,1H3,(H2,17,19)
InChIKeyCOBUUINNZJGJNF-UHFFFAOYSA-N
MW267.29 g/mol
LogP1.92
Rot. Bonds4

About 2-(cyanomethyl)-5-(2-methoxyphenyl)pyridine-4-carboxamide

2-(cyanomethyl)-5-(2-methoxyphenyl)pyridine-4-carboxamide (PubChem CID 155353624) has the molecular formula C15H13N3O2 and a molecular weight of 267.29 g/mol. Its IUPAC name is 2-(cyanomethyl)-5-(2-methoxyphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(cyanomethyl)-5-(2-methoxyphenyl)pyridine-4-carboxamide
PubChem CID155353624
Molecular FormulaC15H13N3O2
Molecular Weight267.29 g/mol
Exact Mass267.10
IUPAC Name2-(cyanomethyl)-5-(2-methoxyphenyl)pyridine-4-carboxamide
SMILESCOc1ccccc1-c1cnc(CC#N)cc1C(N)=O
InChIInChI=1S/C15H13N3O2/c1-20-14-5-3-2-4-11(14)13-9-18-10(6-7-16)8-12(13)15(17)19/h2-5,8-9H,6H2,1H3,(H2,17,19)
InChIKeyCOBUUINNZJGJNF-UHFFFAOYSA-N
XLogP1.92
TPSA89.00 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(cyanomethyl)-5-(2-methoxyphenyl)pyridine-4-carboxamide 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

4-(2-methoxyphenyl)-6-(3-oxobutyl)pyridine-3-carboxamide
CID 155353930
5-(2-methoxyphenyl)-1,2-dimethylpyrrole-3-carboxamide
CID 116828514
2-[6-(2-methoxyphenyl)-3-pyridinyl]acetonitrile
CID 117001949
2-cyano-5-methoxypyridine-4-carboxamide
CID 13238726
2-amino-5-(2-methoxyanilino)pyridine-4-carboxamide
CID 114194675
4,5-dimethoxy-2-phenylbenzamide
CID 141317116
3-(2-methoxyphenyl)-1H-pyrazole-5-carboxamide
CID 156565673
2-(2-methoxy-5-methylphenyl)benzamide
CID 66715055
6-(2-methoxyphenyl)-2-methylpyrimidine-4-carboxamide
CID 67546414
N-[4-(2-carbamoylphenoxy)but-2-ynyl]-3-(2-methoxyphenyl)-1H-pyrazole-5-carboxamide
CID 90580562
5-amino-2-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide
CID 61357803
2-amino-5-(2-methoxyphenyl)pyridine-3-carboxylic acid
CID 53222773

Frequently Asked Questions

What is the IUPAC name of 2-(cyanomethyl)-5-(2-methoxyphenyl)pyridine-4-carboxamide?
The IUPAC name of 2-(cyanomethyl)-5-(2-methoxyphenyl)pyridine-4-carboxamide (CID 155353624) is 2-(cyanomethyl)-5-(2-methoxyphenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-(cyanomethyl)-5-(2-methoxyphenyl)pyridine-4-carboxamide?
The canonical SMILES for 2-(cyanomethyl)-5-(2-methoxyphenyl)pyridine-4-carboxamide is COc1ccccc1-c1cnc(CC#N)cc1C(N)=O.
What is the InChIKey of 2-(cyanomethyl)-5-(2-methoxyphenyl)pyridine-4-carboxamide?
The InChIKey is COBUUINNZJGJNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2/c1-20-14-5-3-2-4-11(14)13-9-18-10(6-7-16)8-12(13)15(17)19/h2-5,8-9H,6H2,1H3,(H2,17,19).
What are the key properties of 2-(cyanomethyl)-5-(2-methoxyphenyl)pyridine-4-carboxamide?
2-(cyanomethyl)-5-(2-methoxyphenyl)pyridine-4-carboxamide has a molecular weight of 267.29 g/mol, XLogP of 1.92, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyanomethyl)-5-(2-methoxyphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 155353624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).