7-hydroxy-1H-quinolin-4-one

C9H7NO2 — CID 39869818

IUPAC7-hydroxy-1H-quinolin-4-one
SMILESO=c1cc[nH]c2cc(O)ccc12
InChIInChI=1S/C9H7NO2/c11-6-1-2-7-8(5-6)10-4-3-9(7)12/h1-5,11H,(H,10,12)
InChIKeyVJOPQSBUEFGOSD-UHFFFAOYSA-N
MW161.16 g/mol
LogP1.23
Rot. Bonds

About 7-hydroxy-1H-quinolin-4-one

7-hydroxy-1H-quinolin-4-one (PubChem CID 39869818) has the molecular formula C9H7NO2 and a molecular weight of 161.16 g/mol. Its IUPAC name is 7-hydroxy-1H-quinolin-4-one.

Molecular Properties

Compound Name7-hydroxy-1H-quinolin-4-one
PubChem CID39869818
Molecular FormulaC9H7NO2
Molecular Weight161.16 g/mol
Exact Mass161.05
IUPAC Name7-hydroxy-1H-quinolin-4-one
SMILESO=c1cc[nH]c2cc(O)ccc12
InChIInChI=1S/C9H7NO2/c11-6-1-2-7-8(5-6)10-4-3-9(7)12/h1-5,11H,(H,10,12)
InChIKeyVJOPQSBUEFGOSD-UHFFFAOYSA-N
XLogP1.23
TPSA53.09 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.16
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 7-hydroxy-1H-quinolin-4-one with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7-hydroxy-1H-quinolin-4-one?
The IUPAC name of 7-hydroxy-1H-quinolin-4-one (CID 39869818) is 7-hydroxy-1H-quinolin-4-one.
What is the SMILES notation for 7-hydroxy-1H-quinolin-4-one?
The canonical SMILES for 7-hydroxy-1H-quinolin-4-one is O=c1cc[nH]c2cc(O)ccc12.
What is the InChIKey of 7-hydroxy-1H-quinolin-4-one?
The InChIKey is VJOPQSBUEFGOSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7NO2/c11-6-1-2-7-8(5-6)10-4-3-9(7)12/h1-5,11H,(H,10,12).
What are the key properties of 7-hydroxy-1H-quinolin-4-one?
7-hydroxy-1H-quinolin-4-one has a molecular weight of 161.16 g/mol, XLogP of 1.23, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxy-1H-quinolin-4-one is sourced from PubChem (CID 39869818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).