2-methyl-6-oxo-N-(pyridin-2-ylmethyl)-1H-pyridine-4-carboxamide

C13H13N3O2 — CID 110698624

IUPAC2-methyl-6-oxo-N-(pyridin-2-ylmethyl)-1H-pyridine-4-carboxamide
SMILESCc1cc(C(=O)NCc2ccccn2)cc(=O)[nH]1
InChIInChI=1S/C13H13N3O2/c1-9-6-10(7-12(17)16-9)13(18)15-8-11-4-2-3-5-14-11/h2-7H,8H2,1H3,(H,15,18)(H,16,17)
InChIKeyWKFSLJLPQZKTSI-UHFFFAOYSA-N
MW243.27 g/mol
LogP1.01
Rot. Bonds3

About 2-methyl-6-oxo-N-(pyridin-2-ylmethyl)-1H-pyridine-4-carboxamide

2-methyl-6-oxo-N-(pyridin-2-ylmethyl)-1H-pyridine-4-carboxamide (PubChem CID 110698624) has the molecular formula C13H13N3O2 and a molecular weight of 243.27 g/mol. Its IUPAC name is 2-methyl-6-oxo-N-(pyridin-2-ylmethyl)-1H-pyridine-4-carboxamide.

Molecular Properties

Compound Name2-methyl-6-oxo-N-(pyridin-2-ylmethyl)-1H-pyridine-4-carboxamide
PubChem CID110698624
Molecular FormulaC13H13N3O2
Molecular Weight243.27 g/mol
Exact Mass243.10
IUPAC Name2-methyl-6-oxo-N-(pyridin-2-ylmethyl)-1H-pyridine-4-carboxamide
SMILESCc1cc(C(=O)NCc2ccccn2)cc(=O)[nH]1
InChIInChI=1S/C13H13N3O2/c1-9-6-10(7-12(17)16-9)13(18)15-8-11-4-2-3-5-14-11/h2-7H,8H2,1H3,(H,15,18)(H,16,17)
InChIKeyWKFSLJLPQZKTSI-UHFFFAOYSA-N
XLogP1.01
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.27
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-methyl-6-oxo-N-(pyridin-2-ylmethyl)-1H-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

3,5-diacetamido-N-(pyridin-2-ylmethyl)benzamide
CID 18107560
2,3-dimethyl-N-(pyridin-2-ylmethyl)-1H-indole-5-carboxamide
CID 2576679
2-(5-methylthiophen-2-yl)-N-(pyridin-2-ylmethyl)pyridine-4-carboxamide
CID 53199668
methyl 4-(pyridin-2-ylmethylcarbamoyl)benzoate
CID 9414602
1-N-(pyridin-2-ylmethyl)-3-N-sulfanylbenzene-1,3-dicarboxamide
CID 143484238
4-oxo-N-(pyridin-2-ylmethyl)-3H-quinazoline-2-carboxamide
CID 135654390
2-oxo-N-(pyridin-2-ylmethyl)-1H-quinoline-3-carboxamide
CID 16589995
3-phenyl-N-(pyridin-2-ylmethyl)benzamide
CID 110724423
4-(methylaminomethyl)-N-(pyridin-2-ylmethyl)benzamide
CID 90338069
3-acetamido-N-(pyridin-2-ylmethyl)benzamide
CID 13177095
4-N-(3,4-dimethylphenyl)-1-N-(pyridin-2-ylmethyl)benzene-1,4-dicarboxamide
CID 109047561
3-N-[(2-methylphenyl)methyl]-5-N-(pyridin-2-ylmethyl)pyridine-3,5-dicarboxamide
CID 109105096

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-oxo-N-(pyridin-2-ylmethyl)-1H-pyridine-4-carboxamide?
The IUPAC name of 2-methyl-6-oxo-N-(pyridin-2-ylmethyl)-1H-pyridine-4-carboxamide (CID 110698624) is 2-methyl-6-oxo-N-(pyridin-2-ylmethyl)-1H-pyridine-4-carboxamide.
What is the SMILES notation for 2-methyl-6-oxo-N-(pyridin-2-ylmethyl)-1H-pyridine-4-carboxamide?
The canonical SMILES for 2-methyl-6-oxo-N-(pyridin-2-ylmethyl)-1H-pyridine-4-carboxamide is Cc1cc(C(=O)NCc2ccccn2)cc(=O)[nH]1.
What is the InChIKey of 2-methyl-6-oxo-N-(pyridin-2-ylmethyl)-1H-pyridine-4-carboxamide?
The InChIKey is WKFSLJLPQZKTSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O2/c1-9-6-10(7-12(17)16-9)13(18)15-8-11-4-2-3-5-14-11/h2-7H,8H2,1H3,(H,15,18)(H,16,17).
What are the key properties of 2-methyl-6-oxo-N-(pyridin-2-ylmethyl)-1H-pyridine-4-carboxamide?
2-methyl-6-oxo-N-(pyridin-2-ylmethyl)-1H-pyridine-4-carboxamide has a molecular weight of 243.27 g/mol, XLogP of 1.01, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-oxo-N-(pyridin-2-ylmethyl)-1H-pyridine-4-carboxamide is sourced from PubChem (CID 110698624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).