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

C11H11NO2 — CID 54683989

IUPAC4-hydroxy-1,3-dimethylquinolin-2-one
SMILESCc1c(O)c2ccccc2n(C)c1=O
InChIInChI=1S/C11H11NO2/c1-7-10(13)8-5-3-4-6-9(8)12(2)11(7)14/h3-6,13H,1-2H3
InChIKeyHIYWPQWKGLOWRH-UHFFFAOYSA-N
MW189.21 g/mol
LogP1.55
Rot. Bonds

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

4-hydroxy-1,3-dimethylquinolin-2-one (PubChem CID 54683989) has the molecular formula C11H11NO2 and a molecular weight of 189.21 g/mol. Its IUPAC name is 4-hydroxy-1,3-dimethylquinolin-2-one.

Molecular Properties

Compound Name4-hydroxy-1,3-dimethylquinolin-2-one
PubChem CID54683989
Molecular FormulaC11H11NO2
Molecular Weight189.21 g/mol
Exact Mass189.08
IUPAC Name4-hydroxy-1,3-dimethylquinolin-2-one
SMILESCc1c(O)c2ccccc2n(C)c1=O
InChIInChI=1S/C11H11NO2/c1-7-10(13)8-5-3-4-6-9(8)12(2)11(7)14/h3-6,13H,1-2H3
InChIKeyHIYWPQWKGLOWRH-UHFFFAOYSA-N
XLogP1.55
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.21
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-hydroxy-1,3-dimethylquinolin-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

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-1,3-dimethylquinolin-2-one?
The IUPAC name of 4-hydroxy-1,3-dimethylquinolin-2-one (CID 54683989) is 4-hydroxy-1,3-dimethylquinolin-2-one.
What is the SMILES notation for 4-hydroxy-1,3-dimethylquinolin-2-one?
The canonical SMILES for 4-hydroxy-1,3-dimethylquinolin-2-one is Cc1c(O)c2ccccc2n(C)c1=O.
What is the InChIKey of 4-hydroxy-1,3-dimethylquinolin-2-one?
The InChIKey is HIYWPQWKGLOWRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO2/c1-7-10(13)8-5-3-4-6-9(8)12(2)11(7)14/h3-6,13H,1-2H3.
What are the key properties of 4-hydroxy-1,3-dimethylquinolin-2-one?
4-hydroxy-1,3-dimethylquinolin-2-one has a molecular weight of 189.21 g/mol, XLogP of 1.55, 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-dimethylquinolin-2-one is sourced from PubChem (CID 54683989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).