3-hydroxy-7-methyl-4aH-quinolin-2-one

C10H9NO2 — CID 74936429

IUPAC3-hydroxy-7-methyl-4aH-quinolin-2-one
SMILESCC1=CC2=NC(=O)C(O)=CC2C=C1
InChIInChI=1S/C10H9NO2/c1-6-2-3-7-5-9(12)10(13)11-8(7)4-6/h2-5,7,12H,1H3
InChIKeyZYRMOVIUBDXCIH-UHFFFAOYSA-N
MW175.19 g/mol
LogP1.54
Rot. Bonds

About 3-hydroxy-7-methyl-4aH-quinolin-2-one

3-hydroxy-7-methyl-4aH-quinolin-2-one (PubChem CID 74936429) has the molecular formula C10H9NO2 and a molecular weight of 175.19 g/mol. Its IUPAC name is 3-hydroxy-7-methyl-4aH-quinolin-2-one.

Molecular Properties

Compound Name3-hydroxy-7-methyl-4aH-quinolin-2-one
PubChem CID74936429
Molecular FormulaC10H9NO2
Molecular Weight175.19 g/mol
Exact Mass175.06
IUPAC Name3-hydroxy-7-methyl-4aH-quinolin-2-one
SMILESCC1=CC2=NC(=O)C(O)=CC2C=C1
InChIInChI=1S/C10H9NO2/c1-6-2-3-7-5-9(12)10(13)11-8(7)4-6/h2-5,7,12H,1H3
InChIKeyZYRMOVIUBDXCIH-UHFFFAOYSA-N
XLogP1.54
TPSA49.66 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-hydroxy-7-methyl-4aH-quinolin-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

5,7-difluoro-3-hydroxy-4aH-quinolin-2-one
CID 74043679
2-Hydroxy-7-methylquinolin-4(4aH)-one
CID 72218615
7-methyl-4aH-quinolin-2-one
CID 72218734
4-hydroxy-3-methyl-4aH-quinolin-2-one
CID 72493337
3-hydroxy-4aH-quinolin-2-one
CID 73455986
8-hydroxy-4aH-quinolin-2-one
CID 73629614
3-hydroxy-5-methyl-4aH-quinolin-2-one
CID 73801996
5,7-dichloro-3-hydroxy-4aH-quinolin-2-one
CID 74043639
3-Hydroxy-6-methylidenequinolin-2-one
CID 74377236
3-Hydroxy-8-methylidenequinolin-2-one
CID 74936483
3-hydroxy-4-methyl-4aH-quinolin-2-one
CID 74940671
4-hydroxy-5,7-dimethyl-4aH-quinolin-2-one
CID 75837145

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-7-methyl-4aH-quinolin-2-one?
The IUPAC name of 3-hydroxy-7-methyl-4aH-quinolin-2-one (CID 74936429) is 3-hydroxy-7-methyl-4aH-quinolin-2-one.
What is the SMILES notation for 3-hydroxy-7-methyl-4aH-quinolin-2-one?
The canonical SMILES for 3-hydroxy-7-methyl-4aH-quinolin-2-one is CC1=CC2=NC(=O)C(O)=CC2C=C1.
What is the InChIKey of 3-hydroxy-7-methyl-4aH-quinolin-2-one?
The InChIKey is ZYRMOVIUBDXCIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NO2/c1-6-2-3-7-5-9(12)10(13)11-8(7)4-6/h2-5,7,12H,1H3.
What are the key properties of 3-hydroxy-7-methyl-4aH-quinolin-2-one?
3-hydroxy-7-methyl-4aH-quinolin-2-one has a molecular weight of 175.19 g/mol, XLogP of 1.54, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-7-methyl-4aH-quinolin-2-one is sourced from PubChem (CID 74936429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).