4-methyl-N-(2-oxo-4,6-diphenyl-1-pyridinyl)-N-phenylbenzamide

C31H24N2O2 — CID 3333477

IUPAC4-methyl-N-(2-oxo-4,6-diphenyl-1-pyridinyl)-N-phenylbenzamide
SMILESCc1ccc(C(=O)N(c2ccccc2)n2c(-c3ccccc3)cc(-c3ccccc3)cc2=O)cc1
InChIInChI=1S/C31H24N2O2/c1-23-17-19-26(20-18-23)31(35)32(28-15-9-4-10-16-28)33-29(25-13-7-3-8-14-25)21-27(22-30(33)34)24-11-5-2-6-12-24/h2-22H,1H3
InChIKeyQGYBYCHMLONLNH-UHFFFAOYSA-N
MW456.55 g/mol
LogP6.60
Rot. Bonds5

About 4-methyl-N-(2-oxo-4,6-diphenyl-1-pyridinyl)-N-phenylbenzamide

4-methyl-N-(2-oxo-4,6-diphenyl-1-pyridinyl)-N-phenylbenzamide (PubChem CID 3333477) has the molecular formula C31H24N2O2 and a molecular weight of 456.55 g/mol. Its IUPAC name is 4-methyl-N-(2-oxo-4,6-diphenyl-1-pyridinyl)-N-phenylbenzamide.

Molecular Properties

Compound Name4-methyl-N-(2-oxo-4,6-diphenyl-1-pyridinyl)-N-phenylbenzamide
PubChem CID3333477
Molecular FormulaC31H24N2O2
Molecular Weight456.55 g/mol
Exact Mass456.18
IUPAC Name4-methyl-N-(2-oxo-4,6-diphenyl-1-pyridinyl)-N-phenylbenzamide
SMILESCc1ccc(C(=O)N(c2ccccc2)n2c(-c3ccccc3)cc(-c3ccccc3)cc2=O)cc1
InChIInChI=1S/C31H24N2O2/c1-23-17-19-26(20-18-23)31(35)32(28-15-9-4-10-16-28)33-29(25-13-7-3-8-14-25)21-27(22-30(33)34)24-11-5-2-6-12-24/h2-22H,1H3
InChIKeyQGYBYCHMLONLNH-UHFFFAOYSA-N
XLogP6.60
TPSA42.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms35
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500456.55
LogP ≤ 56.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(2-oxo-4,6-diphenyl-1-pyridinyl)-N-phenylbenzamide?
The IUPAC name of 4-methyl-N-(2-oxo-4,6-diphenyl-1-pyridinyl)-N-phenylbenzamide (CID 3333477) is 4-methyl-N-(2-oxo-4,6-diphenyl-1-pyridinyl)-N-phenylbenzamide.
What is the SMILES notation for 4-methyl-N-(2-oxo-4,6-diphenyl-1-pyridinyl)-N-phenylbenzamide?
The canonical SMILES for 4-methyl-N-(2-oxo-4,6-diphenyl-1-pyridinyl)-N-phenylbenzamide is Cc1ccc(C(=O)N(c2ccccc2)n2c(-c3ccccc3)cc(-c3ccccc3)cc2=O)cc1.
What is the InChIKey of 4-methyl-N-(2-oxo-4,6-diphenyl-1-pyridinyl)-N-phenylbenzamide?
The InChIKey is QGYBYCHMLONLNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H24N2O2/c1-23-17-19-26(20-18-23)31(35)32(28-15-9-4-10-16-28)33-29(25-13-7-3-8-14-25)21-27(22-30(33)34)24-11-5-2-6-12-24/h2-22H,1H3.
What are the key properties of 4-methyl-N-(2-oxo-4,6-diphenyl-1-pyridinyl)-N-phenylbenzamide?
4-methyl-N-(2-oxo-4,6-diphenyl-1-pyridinyl)-N-phenylbenzamide has a molecular weight of 456.55 g/mol, XLogP of 6.60, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(2-oxo-4,6-diphenyl-1-pyridinyl)-N-phenylbenzamide is sourced from PubChem (CID 3333477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).