1-(4-methylphenyl)-4,6-diphenylpyridin-2-one

C24H19NO — CID 630746

IUPAC1-(4-methylphenyl)-4,6-diphenylpyridin-2-one
SMILESCc1ccc(-n2c(-c3ccccc3)cc(-c3ccccc3)cc2=O)cc1
InChIInChI=1S/C24H19NO/c1-18-12-14-22(15-13-18)25-23(20-10-6-3-7-11-20)16-21(17-24(25)26)19-8-4-2-5-9-19/h2-17H,1H3
InChIKeyGGFSUMSWIRCAEO-UHFFFAOYSA-N
MW337.42 g/mol
LogP5.48
Rot. Bonds3

About 1-(4-methylphenyl)-4,6-diphenylpyridin-2-one

1-(4-methylphenyl)-4,6-diphenylpyridin-2-one (PubChem CID 630746) has the molecular formula C24H19NO and a molecular weight of 337.42 g/mol. Its IUPAC name is 1-(4-methylphenyl)-4,6-diphenylpyridin-2-one.

Molecular Properties

Compound Name1-(4-methylphenyl)-4,6-diphenylpyridin-2-one
PubChem CID630746
Molecular FormulaC24H19NO
Molecular Weight337.42 g/mol
Exact Mass337.15
IUPAC Name1-(4-methylphenyl)-4,6-diphenylpyridin-2-one
SMILESCc1ccc(-n2c(-c3ccccc3)cc(-c3ccccc3)cc2=O)cc1
InChIInChI=1S/C24H19NO/c1-18-12-14-22(15-13-18)25-23(20-10-6-3-7-11-20)16-21(17-24(25)26)19-8-4-2-5-9-19/h2-17H,1H3
InChIKeyGGFSUMSWIRCAEO-UHFFFAOYSA-N
XLogP5.48
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500337.42
LogP ≤ 55.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methylphenyl)-4,6-diphenylpyridin-2-one?
The IUPAC name of 1-(4-methylphenyl)-4,6-diphenylpyridin-2-one (CID 630746) is 1-(4-methylphenyl)-4,6-diphenylpyridin-2-one.
What is the SMILES notation for 1-(4-methylphenyl)-4,6-diphenylpyridin-2-one?
The canonical SMILES for 1-(4-methylphenyl)-4,6-diphenylpyridin-2-one is Cc1ccc(-n2c(-c3ccccc3)cc(-c3ccccc3)cc2=O)cc1.
What is the InChIKey of 1-(4-methylphenyl)-4,6-diphenylpyridin-2-one?
The InChIKey is GGFSUMSWIRCAEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19NO/c1-18-12-14-22(15-13-18)25-23(20-10-6-3-7-11-20)16-21(17-24(25)26)19-8-4-2-5-9-19/h2-17H,1H3.
What are the key properties of 1-(4-methylphenyl)-4,6-diphenylpyridin-2-one?
1-(4-methylphenyl)-4,6-diphenylpyridin-2-one has a molecular weight of 337.42 g/mol, XLogP of 5.48, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylphenyl)-4,6-diphenylpyridin-2-one is sourced from PubChem (CID 630746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).