4-hydroxy-5-methyl-1H-pyridin-2-one

C6H7NO2 — CID 54720146

IUPAC4-hydroxy-5-methyl-1H-pyridin-2-one
SMILESCc1c[nH]c(=O)cc1O
InChIInChI=1S/C6H7NO2/c1-4-3-7-6(9)2-5(4)8/h2-3H,1H3,(H2,7,8,9)
InChIKeyDOTGZUGIZALMLZ-UHFFFAOYSA-N
MW125.13 g/mol
LogP0.39
Rot. Bonds

About 4-hydroxy-5-methyl-1H-pyridin-2-one

4-hydroxy-5-methyl-1H-pyridin-2-one (PubChem CID 54720146) has the molecular formula C6H7NO2 and a molecular weight of 125.13 g/mol. Its IUPAC name is 4-hydroxy-5-methyl-1H-pyridin-2-one.

Molecular Properties

Compound Name4-hydroxy-5-methyl-1H-pyridin-2-one
PubChem CID54720146
Molecular FormulaC6H7NO2
Molecular Weight125.13 g/mol
Exact Mass125.05
IUPAC Name4-hydroxy-5-methyl-1H-pyridin-2-one
SMILESCc1c[nH]c(=O)cc1O
InChIInChI=1S/C6H7NO2/c1-4-3-7-6(9)2-5(4)8/h2-3H,1H3,(H2,7,8,9)
InChIKeyDOTGZUGIZALMLZ-UHFFFAOYSA-N
XLogP0.39
TPSA53.09 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.13
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-5-methyl-1H-pyridin-2-one?
The IUPAC name of 4-hydroxy-5-methyl-1H-pyridin-2-one (CID 54720146) is 4-hydroxy-5-methyl-1H-pyridin-2-one.
What is the SMILES notation for 4-hydroxy-5-methyl-1H-pyridin-2-one?
The canonical SMILES for 4-hydroxy-5-methyl-1H-pyridin-2-one is Cc1c[nH]c(=O)cc1O.
What is the InChIKey of 4-hydroxy-5-methyl-1H-pyridin-2-one?
The InChIKey is DOTGZUGIZALMLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7NO2/c1-4-3-7-6(9)2-5(4)8/h2-3H,1H3,(H2,7,8,9).
What are the key properties of 4-hydroxy-5-methyl-1H-pyridin-2-one?
4-hydroxy-5-methyl-1H-pyridin-2-one has a molecular weight of 125.13 g/mol, XLogP of 0.39, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-5-methyl-1H-pyridin-2-one is sourced from PubChem (CID 54720146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).