4-hydroxy-1,3-dimethylpyridin-2-one

C7H9NO2 — CID 54729666

IUPAC4-hydroxy-1,3-dimethylpyridin-2-one
SMILESCc1c(O)ccn(C)c1=O
InChIInChI=1S/C7H9NO2/c1-5-6(9)3-4-8(2)7(5)10/h3-4,9H,1-2H3
InChIKeyRBKFDBPQPZFRHF-UHFFFAOYSA-N
MW139.15 g/mol
LogP0.40
Rot. Bonds

About 4-hydroxy-1,3-dimethylpyridin-2-one

4-hydroxy-1,3-dimethylpyridin-2-one (PubChem CID 54729666) has the molecular formula C7H9NO2 and a molecular weight of 139.15 g/mol. Its IUPAC name is 4-hydroxy-1,3-dimethylpyridin-2-one.

Molecular Properties

Compound Name4-hydroxy-1,3-dimethylpyridin-2-one
PubChem CID54729666
Molecular FormulaC7H9NO2
Molecular Weight139.15 g/mol
Exact Mass139.06
IUPAC Name4-hydroxy-1,3-dimethylpyridin-2-one
SMILESCc1c(O)ccn(C)c1=O
InChIInChI=1S/C7H9NO2/c1-5-6(9)3-4-8(2)7(5)10/h3-4,9H,1-2H3
InChIKeyRBKFDBPQPZFRHF-UHFFFAOYSA-N
XLogP0.40
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.15
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-Hydroxy-1-methyl-2-oxo-1,2-dihydropyridine-3-carbonitrile
CID 54686421
4-Hydroxy-1-methyl-1,2-dihydropyridin-2-one
CID 54684523
4-Hydroxy-3-methyl-2(1H)-pyridinone
CID 54723665
4-Hydroxy-1-methyl-3-(trifluoromethyl)pyridin-2-one
CID 156069604
4-hydroxy-N,1-dimethyl-2-oxopyridine-3-carboxamide
CID 57619632
1-Ethyl-4-hydroxypyridin-2(1H)-one
CID 57917932
1-Butyl-4-hydroxy-2-oxo-1,2-dihydro-pyridine-3-carbonitrile
CID 59234228
1-butyl-4-hydroxy-1H-pyridine-2-one
CID 59497076
potassium 4-hydroxy-1,5-dimethyl-3-tritio-2H-pyridin-2-id-6-one
CID 59693032
4-Hydroxy-1,3-dimethyl-5-tritiopyridin-2-one
CID 59693033
4-Hydroxy-1-propylpyridin-2-one
CID 70310916
1,4-Dihydroxy-3-methylpyridin-2-one
CID 130345782

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-1,3-dimethylpyridin-2-one?
The IUPAC name of 4-hydroxy-1,3-dimethylpyridin-2-one (CID 54729666) is 4-hydroxy-1,3-dimethylpyridin-2-one.
What is the SMILES notation for 4-hydroxy-1,3-dimethylpyridin-2-one?
The canonical SMILES for 4-hydroxy-1,3-dimethylpyridin-2-one is Cc1c(O)ccn(C)c1=O.
What is the InChIKey of 4-hydroxy-1,3-dimethylpyridin-2-one?
The InChIKey is RBKFDBPQPZFRHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9NO2/c1-5-6(9)3-4-8(2)7(5)10/h3-4,9H,1-2H3.
What are the key properties of 4-hydroxy-1,3-dimethylpyridin-2-one?
4-hydroxy-1,3-dimethylpyridin-2-one has a molecular weight of 139.15 g/mol, XLogP of 0.40, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-1,3-dimethylpyridin-2-one is sourced from PubChem (CID 54729666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).