1-benzyl-N-methyl-2-oxo-N-phenylpyridine-3-carboxamide

C20H18N2O2 — CID 1478498

IUPAC1-benzyl-N-methyl-2-oxo-N-phenylpyridine-3-carboxamide
SMILESCN(C(=O)c1cccn(Cc2ccccc2)c1=O)c1ccccc1
InChIInChI=1S/C20H18N2O2/c1-21(17-11-6-3-7-12-17)19(23)18-13-8-14-22(20(18)24)15-16-9-4-2-5-10-16/h2-14H,15H2,1H3
InChIKeyYFSQGTJIKIGRGG-UHFFFAOYSA-N
MW318.38 g/mol
LogP3.17
Rot. Bonds4

About 1-benzyl-N-methyl-2-oxo-N-phenylpyridine-3-carboxamide

1-benzyl-N-methyl-2-oxo-N-phenylpyridine-3-carboxamide (PubChem CID 1478498) has the molecular formula C20H18N2O2 and a molecular weight of 318.38 g/mol. Its IUPAC name is 1-benzyl-N-methyl-2-oxo-N-phenylpyridine-3-carboxamide.

Molecular Properties

Compound Name1-benzyl-N-methyl-2-oxo-N-phenylpyridine-3-carboxamide
PubChem CID1478498
Molecular FormulaC20H18N2O2
Molecular Weight318.38 g/mol
Exact Mass318.14
IUPAC Name1-benzyl-N-methyl-2-oxo-N-phenylpyridine-3-carboxamide
SMILESCN(C(=O)c1cccn(Cc2ccccc2)c1=O)c1ccccc1
InChIInChI=1S/C20H18N2O2/c1-21(17-11-6-3-7-12-17)19(23)18-13-8-14-22(20(18)24)15-16-9-4-2-5-10-16/h2-14H,15H2,1H3
InChIKeyYFSQGTJIKIGRGG-UHFFFAOYSA-N
XLogP3.17
TPSA42.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 53.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-benzyl-N-methyl-2-oxo-N-phenylpyridine-3-carboxamide?
The IUPAC name of 1-benzyl-N-methyl-2-oxo-N-phenylpyridine-3-carboxamide (CID 1478498) is 1-benzyl-N-methyl-2-oxo-N-phenylpyridine-3-carboxamide.
What is the SMILES notation for 1-benzyl-N-methyl-2-oxo-N-phenylpyridine-3-carboxamide?
The canonical SMILES for 1-benzyl-N-methyl-2-oxo-N-phenylpyridine-3-carboxamide is CN(C(=O)c1cccn(Cc2ccccc2)c1=O)c1ccccc1.
What is the InChIKey of 1-benzyl-N-methyl-2-oxo-N-phenylpyridine-3-carboxamide?
The InChIKey is YFSQGTJIKIGRGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O2/c1-21(17-11-6-3-7-12-17)19(23)18-13-8-14-22(20(18)24)15-16-9-4-2-5-10-16/h2-14H,15H2,1H3.
What are the key properties of 1-benzyl-N-methyl-2-oxo-N-phenylpyridine-3-carboxamide?
1-benzyl-N-methyl-2-oxo-N-phenylpyridine-3-carboxamide has a molecular weight of 318.38 g/mol, XLogP of 3.17, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-N-methyl-2-oxo-N-phenylpyridine-3-carboxamide is sourced from PubChem (CID 1478498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).