3-(hydroxymethyl)-6-phenyl-1H-pyridin-2-one

C12H11NO2 — CID 82521366

IUPAC3-(hydroxymethyl)-6-phenyl-1H-pyridin-2-one
SMILESO=c1[nH]c(-c2ccccc2)ccc1CO
InChIInChI=1S/C12H11NO2/c14-8-10-6-7-11(13-12(10)15)9-4-2-1-3-5-9/h1-7,14H,8H2,(H,13,15)
InChIKeyYNRSAGBVRDIHEH-UHFFFAOYSA-N
MW201.22 g/mol
LogP1.53
Rot. Bonds2

About 3-(hydroxymethyl)-6-phenyl-1H-pyridin-2-one

3-(hydroxymethyl)-6-phenyl-1H-pyridin-2-one (PubChem CID 82521366) has the molecular formula C12H11NO2 and a molecular weight of 201.22 g/mol. Its IUPAC name is 3-(hydroxymethyl)-6-phenyl-1H-pyridin-2-one.

Molecular Properties

Compound Name3-(hydroxymethyl)-6-phenyl-1H-pyridin-2-one
PubChem CID82521366
Molecular FormulaC12H11NO2
Molecular Weight201.22 g/mol
Exact Mass201.08
IUPAC Name3-(hydroxymethyl)-6-phenyl-1H-pyridin-2-one
SMILESO=c1[nH]c(-c2ccccc2)ccc1CO
InChIInChI=1S/C12H11NO2/c14-8-10-6-7-11(13-12(10)15)9-4-2-1-3-5-9/h1-7,14H,8H2,(H,13,15)
InChIKeyYNRSAGBVRDIHEH-UHFFFAOYSA-N
XLogP1.53
TPSA53.09 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.22
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-Oxo-6-phenyl-1,2-dihydropyridine-3-carboxylic acid
CID 2767304
3-(Hydroxymethyl)-1,2-dihydroquinolin-2-one
CID 2764578
2-Hydroxy-6-(4-methylphenyl)pyridine-3-carboxylic acid
CID 10242910
2-Hydroxy-6-phenylpyridine-4-carboxylic acid
CID 18422120
6-(3-Methylphenyl)-2-oxo-1,2-dihydropyridine-3-carboxylic acid
CID 29996948
2(1H)-Pyridone, 4-hydroxy-6-phenyl-
CID 54713550
7-Fluoro-3-(hydroxymethyl)-1,2-dihydroquinolin-2-one
CID 24276386
ethyl 4-methyl-2-oxo-6-phenyl-1H-pyridine-3-carboxylate
CID 13837924
6-(2,4-Difluorophenyl)-2-oxo-1,2-dihydropyridine-3-carboxylic acid
CID 45496333
6-fluoro-3-(hydroxymethyl)-1H-quinolin-2-one
CID 22509368
6-(4-Fluorophenyl)-2-oxo-1,2-dihydropyridine-3-carboxylic acid
CID 45496334
6-(3,4-difluorophenyl)-2-oxo-1H-pyridine-3-carboxylic acid
CID 61658692

Frequently Asked Questions

What is the IUPAC name of 3-(hydroxymethyl)-6-phenyl-1H-pyridin-2-one?
The IUPAC name of 3-(hydroxymethyl)-6-phenyl-1H-pyridin-2-one (CID 82521366) is 3-(hydroxymethyl)-6-phenyl-1H-pyridin-2-one.
What is the SMILES notation for 3-(hydroxymethyl)-6-phenyl-1H-pyridin-2-one?
The canonical SMILES for 3-(hydroxymethyl)-6-phenyl-1H-pyridin-2-one is O=c1[nH]c(-c2ccccc2)ccc1CO.
What is the InChIKey of 3-(hydroxymethyl)-6-phenyl-1H-pyridin-2-one?
The InChIKey is YNRSAGBVRDIHEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NO2/c14-8-10-6-7-11(13-12(10)15)9-4-2-1-3-5-9/h1-7,14H,8H2,(H,13,15).
What are the key properties of 3-(hydroxymethyl)-6-phenyl-1H-pyridin-2-one?
3-(hydroxymethyl)-6-phenyl-1H-pyridin-2-one has a molecular weight of 201.22 g/mol, XLogP of 1.53, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(hydroxymethyl)-6-phenyl-1H-pyridin-2-one is sourced from PubChem (CID 82521366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).