4-hydroxy-6-methoxy-1,7-dimethylquinolin-2-one

C12H13NO3 — CID 54738968

IUPAC4-hydroxy-6-methoxy-1,7-dimethylquinolin-2-one
SMILESCOc1cc2c(O)cc(=O)n(C)c2cc1C
InChIInChI=1S/C12H13NO3/c1-7-4-9-8(5-11(7)16-3)10(14)6-12(15)13(9)2/h4-6,14H,1-3H3
InChIKeyGUSXOJAAJXDATJ-UHFFFAOYSA-N
MW219.24 g/mol
LogP1.56
Rot. Bonds1

About 4-hydroxy-6-methoxy-1,7-dimethylquinolin-2-one

4-hydroxy-6-methoxy-1,7-dimethylquinolin-2-one (PubChem CID 54738968) has the molecular formula C12H13NO3 and a molecular weight of 219.24 g/mol. Its IUPAC name is 4-hydroxy-6-methoxy-1,7-dimethylquinolin-2-one.

Molecular Properties

Compound Name4-hydroxy-6-methoxy-1,7-dimethylquinolin-2-one
PubChem CID54738968
Molecular FormulaC12H13NO3
Molecular Weight219.24 g/mol
Exact Mass219.09
IUPAC Name4-hydroxy-6-methoxy-1,7-dimethylquinolin-2-one
SMILESCOc1cc2c(O)cc(=O)n(C)c2cc1C
InChIInChI=1S/C12H13NO3/c1-7-4-9-8(5-11(7)16-3)10(14)6-12(15)13(9)2/h4-6,14H,1-3H3
InChIKeyGUSXOJAAJXDATJ-UHFFFAOYSA-N
XLogP1.56
TPSA51.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.24
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-hydroxy-6-methoxy-1,7-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

Related Compounds

(3E)-3-[(2-chloro-5-methoxy-1,6-dimethylindol-3-yl)methylidene]-5-hydroxy-6-methyl-1H-indol-2-one
CID 16738491
4-hydroxy-8,9-dimethoxy-6-methylpyrano[3,2-c]quinoline-2,5-dione
CID 54705973
10-hydroxy-1,4,6,9-tetramethylpyrido[3,2-g]quinoline-2,8-dione
CID 69004958
9-hydroxy-6-methoxy-1,1,7-trimethylphenanthren-2-one
CID 71456927
5,6-dimethoxy-1,2,3-trimethylindole
CID 21049658
1,4-dimethoxy-2,5-dimethylbenzene;dihydrochloride
CID 172845974
1,3,5,6-tetramethylbenzimidazol-2-one
CID 23560568
5,6-dimethoxy-1,3-dimethylindole-2-carbaldehyde
CID 82496043
2,5-dimethoxy-3,4-dimethylphenol
CID 84658444
6,7-dimethoxy-2,3-dimethylisoquinolin-1-one
CID 5257820
ethane;1-methoxy-2,4,5-trimethylbenzene
CID 143418687
6-methoxy-1,5-dimethylindole-2-carbaldehyde
CID 105455209

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-6-methoxy-1,7-dimethylquinolin-2-one?
The IUPAC name of 4-hydroxy-6-methoxy-1,7-dimethylquinolin-2-one (CID 54738968) is 4-hydroxy-6-methoxy-1,7-dimethylquinolin-2-one.
What is the SMILES notation for 4-hydroxy-6-methoxy-1,7-dimethylquinolin-2-one?
The canonical SMILES for 4-hydroxy-6-methoxy-1,7-dimethylquinolin-2-one is COc1cc2c(O)cc(=O)n(C)c2cc1C.
What is the InChIKey of 4-hydroxy-6-methoxy-1,7-dimethylquinolin-2-one?
The InChIKey is GUSXOJAAJXDATJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO3/c1-7-4-9-8(5-11(7)16-3)10(14)6-12(15)13(9)2/h4-6,14H,1-3H3.
What are the key properties of 4-hydroxy-6-methoxy-1,7-dimethylquinolin-2-one?
4-hydroxy-6-methoxy-1,7-dimethylquinolin-2-one has a molecular weight of 219.24 g/mol, XLogP of 1.56, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-6-methoxy-1,7-dimethylquinolin-2-one is sourced from PubChem (CID 54738968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).