3-(hydroxymethyl)-6-(4-methoxy-3-methylphenyl)-1H-pyridin-2-one

C14H15NO3 — CID 82517389

IUPAC3-(hydroxymethyl)-6-(4-methoxy-3-methylphenyl)-1H-pyridin-2-one
SMILESCOc1ccc(-c2ccc(CO)c(=O)[nH]2)cc1C
InChIInChI=1S/C14H15NO3/c1-9-7-10(4-6-13(9)18-2)12-5-3-11(8-16)14(17)15-12/h3-7,16H,8H2,1-2H3,(H,15,17)
InChIKeyFHMFZJZXOIEVAJ-UHFFFAOYSA-N
MW245.28 g/mol
LogP1.85
Rot. Bonds3

About 3-(hydroxymethyl)-6-(4-methoxy-3-methylphenyl)-1H-pyridin-2-one

3-(hydroxymethyl)-6-(4-methoxy-3-methylphenyl)-1H-pyridin-2-one (PubChem CID 82517389) has the molecular formula C14H15NO3 and a molecular weight of 245.28 g/mol. Its IUPAC name is 3-(hydroxymethyl)-6-(4-methoxy-3-methylphenyl)-1H-pyridin-2-one.

Molecular Properties

Compound Name3-(hydroxymethyl)-6-(4-methoxy-3-methylphenyl)-1H-pyridin-2-one
PubChem CID82517389
Molecular FormulaC14H15NO3
Molecular Weight245.28 g/mol
Exact Mass245.11
IUPAC Name3-(hydroxymethyl)-6-(4-methoxy-3-methylphenyl)-1H-pyridin-2-one
SMILESCOc1ccc(-c2ccc(CO)c(=O)[nH]2)cc1C
InChIInChI=1S/C14H15NO3/c1-9-7-10(4-6-13(9)18-2)12-5-3-11(8-16)14(17)15-12/h3-7,16H,8H2,1-2H3,(H,15,17)
InChIKeyFHMFZJZXOIEVAJ-UHFFFAOYSA-N
XLogP1.85
TPSA62.32 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-(hydroxymethyl)-6-(4-methoxy-3-methylphenyl)-1H-pyridin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(aminomethyl)-6-(4-methoxy-3-methylphenyl)-1H-pyridin-2-one
CID 82517371
3-(chloromethyl)-6-(3,4-dimethylphenyl)-1H-pyridin-2-one
CID 82520164
3-(hydroxymethyl)-6-(3-methylphenyl)-1H-pyridin-2-one
CID 176681559
6-(3,4-dimethoxyphenyl)-3-(propylaminomethyl)-1H-pyridin-2-one
CID 82517620
3-(hydroxymethyl)-6-(4-propan-2-ylphenyl)-1H-pyridin-2-one
CID 82520486
3-(hydroxymethyl)-6-phenyl-1H-pyridin-2-one
CID 82521366
[2-(4-methoxy-3-methylphenyl)-1H-imidazol-5-yl]methanol
CID 63108344
6-(3,4-dimethylphenyl)-3-[(2-methoxyethylamino)methyl]-1H-pyridin-2-one
CID 82520167
2-[6-[4-methoxy-3-[(E)-prop-1-enyl]phenyl]-2-oxo-1H-pyridin-3-yl]acetic acid
CID 70067324
1-butan-2-yl-3-(hydroxymethyl)-6-(4-methoxy-3-methylphenyl)pyridin-2-one
CID 82517277
methyl 5-(4-methoxy-3-methylphenyl)-3-methyl-1H-pyrrole-2-carboxylate
CID 135397515
methane;1-methoxy-4-(4-methoxy-3-methylphenyl)-2-methylbenzene
CID 161175155

Frequently Asked Questions

What is the IUPAC name of 3-(hydroxymethyl)-6-(4-methoxy-3-methylphenyl)-1H-pyridin-2-one?
The IUPAC name of 3-(hydroxymethyl)-6-(4-methoxy-3-methylphenyl)-1H-pyridin-2-one (CID 82517389) is 3-(hydroxymethyl)-6-(4-methoxy-3-methylphenyl)-1H-pyridin-2-one.
What is the SMILES notation for 3-(hydroxymethyl)-6-(4-methoxy-3-methylphenyl)-1H-pyridin-2-one?
The canonical SMILES for 3-(hydroxymethyl)-6-(4-methoxy-3-methylphenyl)-1H-pyridin-2-one is COc1ccc(-c2ccc(CO)c(=O)[nH]2)cc1C.
What is the InChIKey of 3-(hydroxymethyl)-6-(4-methoxy-3-methylphenyl)-1H-pyridin-2-one?
The InChIKey is FHMFZJZXOIEVAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO3/c1-9-7-10(4-6-13(9)18-2)12-5-3-11(8-16)14(17)15-12/h3-7,16H,8H2,1-2H3,(H,15,17).
What are the key properties of 3-(hydroxymethyl)-6-(4-methoxy-3-methylphenyl)-1H-pyridin-2-one?
3-(hydroxymethyl)-6-(4-methoxy-3-methylphenyl)-1H-pyridin-2-one has a molecular weight of 245.28 g/mol, XLogP of 1.85, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(hydroxymethyl)-6-(4-methoxy-3-methylphenyl)-1H-pyridin-2-one is sourced from PubChem (CID 82517389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).