1-(4-methylphenyl)pyridin-2-one

C12H11NO — CID 10821386

IUPAC1-(4-methylphenyl)pyridin-2-one
SMILESCc1ccc(-n2ccccc2=O)cc1
InChIInChI=1S/C12H11NO/c1-10-5-7-11(8-6-10)13-9-3-2-4-12(13)14/h2-9H,1H3
InChIKeyQSHAMMNTKISIFS-UHFFFAOYSA-N
MW185.23 g/mol
LogP2.15
Rot. Bonds1

About 1-(4-methylphenyl)pyridin-2-one

1-(4-methylphenyl)pyridin-2-one (PubChem CID 10821386) has the molecular formula C12H11NO and a molecular weight of 185.23 g/mol. Its IUPAC name is 1-(4-methylphenyl)pyridin-2-one.

Molecular Properties

Compound Name1-(4-methylphenyl)pyridin-2-one
PubChem CID10821386
Molecular FormulaC12H11NO
Molecular Weight185.23 g/mol
Exact Mass185.08
IUPAC Name1-(4-methylphenyl)pyridin-2-one
SMILESCc1ccc(-n2ccccc2=O)cc1
InChIInChI=1S/C12H11NO/c1-10-5-7-11(8-6-10)13-9-3-2-4-12(13)14/h2-9H,1H3
InChIKeyQSHAMMNTKISIFS-UHFFFAOYSA-N
XLogP2.15
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.23
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methylphenyl)pyridin-2-one?
The IUPAC name of 1-(4-methylphenyl)pyridin-2-one (CID 10821386) is 1-(4-methylphenyl)pyridin-2-one.
What is the SMILES notation for 1-(4-methylphenyl)pyridin-2-one?
The canonical SMILES for 1-(4-methylphenyl)pyridin-2-one is Cc1ccc(-n2ccccc2=O)cc1.
What is the InChIKey of 1-(4-methylphenyl)pyridin-2-one?
The InChIKey is QSHAMMNTKISIFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NO/c1-10-5-7-11(8-6-10)13-9-3-2-4-12(13)14/h2-9H,1H3.
What are the key properties of 1-(4-methylphenyl)pyridin-2-one?
1-(4-methylphenyl)pyridin-2-one has a molecular weight of 185.23 g/mol, XLogP of 2.15, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylphenyl)pyridin-2-one is sourced from PubChem (CID 10821386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).