4-hydroxy-7-methoxy-1,3-dimethylquinolin-2-one

C12H13NO3 — CID 54690098

IUPAC4-hydroxy-7-methoxy-1,3-dimethylquinolin-2-one
SMILESCOc1ccc2c(O)c(C)c(=O)n(C)c2c1
InChIInChI=1S/C12H13NO3/c1-7-11(14)9-5-4-8(16-3)6-10(9)13(2)12(7)15/h4-6,14H,1-3H3
InChIKeyAMUHOMWWHQMVEJ-UHFFFAOYSA-N
MW219.24 g/mol
LogP1.56
Rot. Bonds1

About 4-hydroxy-7-methoxy-1,3-dimethylquinolin-2-one

4-hydroxy-7-methoxy-1,3-dimethylquinolin-2-one (PubChem CID 54690098) has the molecular formula C12H13NO3 and a molecular weight of 219.24 g/mol. Its IUPAC name is 4-hydroxy-7-methoxy-1,3-dimethylquinolin-2-one.

Molecular Properties

Compound Name4-hydroxy-7-methoxy-1,3-dimethylquinolin-2-one
PubChem CID54690098
Molecular FormulaC12H13NO3
Molecular Weight219.24 g/mol
Exact Mass219.09
IUPAC Name4-hydroxy-7-methoxy-1,3-dimethylquinolin-2-one
SMILESCOc1ccc2c(O)c(C)c(=O)n(C)c2c1
InChIInChI=1S/C12H13NO3/c1-7-11(14)9-5-4-8(16-3)6-10(9)13(2)12(7)15/h4-6,14H,1-3H3
InChIKeyAMUHOMWWHQMVEJ-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

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Related Compounds

2-hydroxy-N-(4-methoxybenzyl)-1-methyl-4-oxo-1,4-dihydroquinoline-3-carboxamide
CID 54676949
7-Methoxy-4-methylquinolin-2-ol
CID 761548
2-Hydroxy-7-methoxyquinoline-3-carbaldehyde
CID 600262
1-ethyl-2-hydroxy-N-(4-methoxybenzyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
CID 54692913
methyl 5-hydroxy-1-[(4-methoxyphenyl)methyl]-2-oxo-3H-1-benzazepine-4-carboxylate
CID 168283671
4-Hydroxy-7-methoxy-3-phenylquinolin-2(1H)-one
CID 54704900
Semecarpifoline
CID 10857848
N-(2-(7-methoxy-2-oxo-1,2-dihydroquinolin-3-yl)ethyl)pentanamide
CID 3243645
3-(Cyclohexyliminomethyl)-4-hydroxy-7-methoxy-1-pentylquinolin-2-one
CID 135995944
3-(4-Hydroxyphenyl)-5,7-dimethoxy-1-methylquinolin-2-one
CID 11066899
5,7-Dimethoxy-3-(4-methoxyphenyl)-1-methyl-1,2-dihydroquinolin-2-one
CID 11067335
7-Methoxy-1,2-dihydroquinolin-2-one
CID 29942756

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-7-methoxy-1,3-dimethylquinolin-2-one?
The IUPAC name of 4-hydroxy-7-methoxy-1,3-dimethylquinolin-2-one (CID 54690098) is 4-hydroxy-7-methoxy-1,3-dimethylquinolin-2-one.
What is the SMILES notation for 4-hydroxy-7-methoxy-1,3-dimethylquinolin-2-one?
The canonical SMILES for 4-hydroxy-7-methoxy-1,3-dimethylquinolin-2-one is COc1ccc2c(O)c(C)c(=O)n(C)c2c1.
What is the InChIKey of 4-hydroxy-7-methoxy-1,3-dimethylquinolin-2-one?
The InChIKey is AMUHOMWWHQMVEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO3/c1-7-11(14)9-5-4-8(16-3)6-10(9)13(2)12(7)15/h4-6,14H,1-3H3.
What are the key properties of 4-hydroxy-7-methoxy-1,3-dimethylquinolin-2-one?
4-hydroxy-7-methoxy-1,3-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-7-methoxy-1,3-dimethylquinolin-2-one is sourced from PubChem (CID 54690098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).