1-benzyl-4-hydroxy-6-methyl-3-phenylpyridin-2-one

C19H17NO2 — CID 54713545

IUPAC1-benzyl-4-hydroxy-6-methyl-3-phenylpyridin-2-one
SMILESCc1cc(O)c(-c2ccccc2)c(=O)n1Cc1ccccc1
InChIInChI=1S/C19H17NO2/c1-14-12-17(21)18(16-10-6-3-7-11-16)19(22)20(14)13-15-8-4-2-5-9-15/h2-12,21H,13H2,1H3
InChIKeyRZBOPXHYKKLDBL-UHFFFAOYSA-N
MW291.35 g/mol
LogP3.58
Rot. Bonds3

About 1-benzyl-4-hydroxy-6-methyl-3-phenylpyridin-2-one

1-benzyl-4-hydroxy-6-methyl-3-phenylpyridin-2-one (PubChem CID 54713545) has the molecular formula C19H17NO2 and a molecular weight of 291.35 g/mol. Its IUPAC name is 1-benzyl-4-hydroxy-6-methyl-3-phenylpyridin-2-one.

Molecular Properties

Compound Name1-benzyl-4-hydroxy-6-methyl-3-phenylpyridin-2-one
PubChem CID54713545
Molecular FormulaC19H17NO2
Molecular Weight291.35 g/mol
Exact Mass291.13
IUPAC Name1-benzyl-4-hydroxy-6-methyl-3-phenylpyridin-2-one
SMILESCc1cc(O)c(-c2ccccc2)c(=O)n1Cc1ccccc1
InChIInChI=1S/C19H17NO2/c1-14-12-17(21)18(16-10-6-3-7-11-16)19(22)20(14)13-15-8-4-2-5-9-15/h2-12,21H,13H2,1H3
InChIKeyRZBOPXHYKKLDBL-UHFFFAOYSA-N
XLogP3.58
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-benzyl-4-hydroxy-6-methyl-3-phenylpyridin-2-one?
The IUPAC name of 1-benzyl-4-hydroxy-6-methyl-3-phenylpyridin-2-one (CID 54713545) is 1-benzyl-4-hydroxy-6-methyl-3-phenylpyridin-2-one.
What is the SMILES notation for 1-benzyl-4-hydroxy-6-methyl-3-phenylpyridin-2-one?
The canonical SMILES for 1-benzyl-4-hydroxy-6-methyl-3-phenylpyridin-2-one is Cc1cc(O)c(-c2ccccc2)c(=O)n1Cc1ccccc1.
What is the InChIKey of 1-benzyl-4-hydroxy-6-methyl-3-phenylpyridin-2-one?
The InChIKey is RZBOPXHYKKLDBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO2/c1-14-12-17(21)18(16-10-6-3-7-11-16)19(22)20(14)13-15-8-4-2-5-9-15/h2-12,21H,13H2,1H3.
What are the key properties of 1-benzyl-4-hydroxy-6-methyl-3-phenylpyridin-2-one?
1-benzyl-4-hydroxy-6-methyl-3-phenylpyridin-2-one has a molecular weight of 291.35 g/mol, XLogP of 3.58, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-4-hydroxy-6-methyl-3-phenylpyridin-2-one is sourced from PubChem (CID 54713545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).