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

C12H11NO2 — CID 10397916

IUPAC3-hydroxy-2-methyl-1-phenylpyridin-4-one
SMILESCc1c(O)c(=O)ccn1-c1ccccc1
InChIInChI=1S/C12H11NO2/c1-9-12(15)11(14)7-8-13(9)10-5-3-2-4-6-10/h2-8,15H,1H3
InChIKeyBNXSABDYGOUQQI-UHFFFAOYSA-N
MW201.22 g/mol
LogP1.85
Rot. Bonds1

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

3-hydroxy-2-methyl-1-phenylpyridin-4-one (PubChem CID 10397916) has the molecular formula C12H11NO2 and a molecular weight of 201.22 g/mol. Its IUPAC name is 3-hydroxy-2-methyl-1-phenylpyridin-4-one.

Molecular Properties

Compound Name3-hydroxy-2-methyl-1-phenylpyridin-4-one
PubChem CID10397916
Molecular FormulaC12H11NO2
Molecular Weight201.22 g/mol
Exact Mass201.08
IUPAC Name3-hydroxy-2-methyl-1-phenylpyridin-4-one
SMILESCc1c(O)c(=O)ccn1-c1ccccc1
InChIInChI=1S/C12H11NO2/c1-9-12(15)11(14)7-8-13(9)10-5-3-2-4-6-10/h2-8,15H,1H3
InChIKeyBNXSABDYGOUQQI-UHFFFAOYSA-N
XLogP1.85
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.22
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-2-methyl-1-phenylpyridin-4-one?
The IUPAC name of 3-hydroxy-2-methyl-1-phenylpyridin-4-one (CID 10397916) is 3-hydroxy-2-methyl-1-phenylpyridin-4-one.
What is the SMILES notation for 3-hydroxy-2-methyl-1-phenylpyridin-4-one?
The canonical SMILES for 3-hydroxy-2-methyl-1-phenylpyridin-4-one is Cc1c(O)c(=O)ccn1-c1ccccc1.
What is the InChIKey of 3-hydroxy-2-methyl-1-phenylpyridin-4-one?
The InChIKey is BNXSABDYGOUQQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NO2/c1-9-12(15)11(14)7-8-13(9)10-5-3-2-4-6-10/h2-8,15H,1H3.
What are the key properties of 3-hydroxy-2-methyl-1-phenylpyridin-4-one?
3-hydroxy-2-methyl-1-phenylpyridin-4-one has a molecular weight of 201.22 g/mol, XLogP of 1.85, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-2-methyl-1-phenylpyridin-4-one is sourced from PubChem (CID 10397916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).