4-hydroxy-6-methyl-1-(2-oxopropyl)pyridin-2-one

C9H11NO3 — CID 59085682

IUPAC4-hydroxy-6-methyl-1-(2-oxopropyl)pyridin-2-one
SMILESCC(=O)Cn1c(C)cc(O)cc1=O
InChIInChI=1S/C9H11NO3/c1-6-3-8(12)4-9(13)10(6)5-7(2)11/h3-4,12H,5H2,1-2H3
InChIKeyFFYQNADWMABWCG-UHFFFAOYSA-N
MW181.19 g/mol
LogP0.45
Rot. Bonds2

About 4-hydroxy-6-methyl-1-(2-oxopropyl)pyridin-2-one

4-hydroxy-6-methyl-1-(2-oxopropyl)pyridin-2-one (PubChem CID 59085682) has the molecular formula C9H11NO3 and a molecular weight of 181.19 g/mol. Its IUPAC name is 4-hydroxy-6-methyl-1-(2-oxopropyl)pyridin-2-one.

Molecular Properties

Compound Name4-hydroxy-6-methyl-1-(2-oxopropyl)pyridin-2-one
PubChem CID59085682
Molecular FormulaC9H11NO3
Molecular Weight181.19 g/mol
Exact Mass181.07
IUPAC Name4-hydroxy-6-methyl-1-(2-oxopropyl)pyridin-2-one
SMILESCC(=O)Cn1c(C)cc(O)cc1=O
InChIInChI=1S/C9H11NO3/c1-6-3-8(12)4-9(13)10(6)5-7(2)11/h3-4,12H,5H2,1-2H3
InChIKeyFFYQNADWMABWCG-UHFFFAOYSA-N
XLogP0.45
TPSA59.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.19
LogP ≤ 50.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-aminoethyl)-4-hydroxy-6-methylpyridin-2-one
CID 82503073
4-hydroxy-6-methyl-1-(2-methylbutyl)pyridin-2-one
CID 102551192
N-(2-adamantyl)-2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-methylacetamide
CID 99716852
2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-(pyridin-2-ylmethyl)acetamide
CID 75489429
N-(3-acetamidophenyl)-3-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)propanamide
CID 71827760
2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-[[4-(4-methoxyphenyl)phenyl]methyl]acetamide
CID 154862308
2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-(6-methoxy-3-pyridinyl)acetamide
CID 75489853
N-(4-fluoro-3-propan-2-ylphenyl)-2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)acetamide
CID 166286792
1-[2-[(4aS,7aR)-4-methyl-2,3,4a,5,7,7a-hexahydropyrrolo[3,4-b][1,4]oxazin-6-yl]-2-oxoethyl]-4-hydroxy-6-methylpyridin-2-one
CID 122084613
1-[2-[(3S)-1,3-dimethyl-3,4-dihydro-2H-1,5-benzodiazepin-5-yl]-2-oxoethyl]-4-hydroxy-6-methylpyridin-2-one
CID 124574353
2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-(4-methyl-3-thiophen-3-ylphenyl)acetamide
CID 166350497
2-(4-hydroxy-2-methyl-6-oxo-1-pyridinyl)-N-[3-[4-(trifluoromethyl)phenyl]prop-2-ynyl]acetamide
CID 166219256

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-6-methyl-1-(2-oxopropyl)pyridin-2-one?
The IUPAC name of 4-hydroxy-6-methyl-1-(2-oxopropyl)pyridin-2-one (CID 59085682) is 4-hydroxy-6-methyl-1-(2-oxopropyl)pyridin-2-one.
What is the SMILES notation for 4-hydroxy-6-methyl-1-(2-oxopropyl)pyridin-2-one?
The canonical SMILES for 4-hydroxy-6-methyl-1-(2-oxopropyl)pyridin-2-one is CC(=O)Cn1c(C)cc(O)cc1=O.
What is the InChIKey of 4-hydroxy-6-methyl-1-(2-oxopropyl)pyridin-2-one?
The InChIKey is FFYQNADWMABWCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO3/c1-6-3-8(12)4-9(13)10(6)5-7(2)11/h3-4,12H,5H2,1-2H3.
What are the key properties of 4-hydroxy-6-methyl-1-(2-oxopropyl)pyridin-2-one?
4-hydroxy-6-methyl-1-(2-oxopropyl)pyridin-2-one has a molecular weight of 181.19 g/mol, XLogP of 0.45, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-6-methyl-1-(2-oxopropyl)pyridin-2-one is sourced from PubChem (CID 59085682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).