5-methoxy-2,3-dimethyl-1H-quinolin-4-one

C12H13NO2 — CID 119083522

IUPAC5-methoxy-2,3-dimethyl-1H-quinolin-4-one
SMILESCOc1cccc2[nH]c(C)c(C)c(=O)c12
InChIInChI=1S/C12H13NO2/c1-7-8(2)13-9-5-4-6-10(15-3)11(9)12(7)14/h4-6H,1-3H3,(H,13,14)
InChIKeyNDICKKORDURBPV-UHFFFAOYSA-N
MW203.24 g/mol
LogP2.15
Rot. Bonds1

About 5-methoxy-2,3-dimethyl-1H-quinolin-4-one

5-methoxy-2,3-dimethyl-1H-quinolin-4-one (PubChem CID 119083522) has the molecular formula C12H13NO2 and a molecular weight of 203.24 g/mol. Its IUPAC name is 5-methoxy-2,3-dimethyl-1H-quinolin-4-one.

Molecular Properties

Compound Name5-methoxy-2,3-dimethyl-1H-quinolin-4-one
PubChem CID119083522
Molecular FormulaC12H13NO2
Molecular Weight203.24 g/mol
Exact Mass203.09
IUPAC Name5-methoxy-2,3-dimethyl-1H-quinolin-4-one
SMILESCOc1cccc2[nH]c(C)c(C)c(=O)c12
InChIInChI=1S/C12H13NO2/c1-7-8(2)13-9-5-4-6-10(15-3)11(9)12(7)14/h4-6H,1-3H3,(H,13,14)
InChIKeyNDICKKORDURBPV-UHFFFAOYSA-N
XLogP2.15
TPSA42.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

bis(4-methoxy-2-methyl-1H-indol-3-yl)methanone
CID 143294111
1-(4-methoxy-2-methyl-1H-indol-3-yl)-2-methylpropan-1-one
CID 82279193
4-hydroxy-5-methoxy-1H-quinolin-2-one
CID 54718133
5-methoxy-4-oxo-2-phenyl-1H-quinoline-3-carboxylic acid
CID 91555555
(E)-3-(4-methoxy-2-methyl-1H-indol-3-yl)but-2-enoic acid
CID 82279144
3-acetyl-5-methoxy-2-methylsulfanyl-1H-quinolin-4-one
CID 164884874
N,N-diethyl-4-methoxy-2-methyl-1H-indole-3-carboxamide
CID 110855129
4-methoxy-3-(4-methoxyphenyl)-2-methyl-1H-indole
CID 13415856
1,8-dihydroxy-4-methoxy-10H-acridin-9-one
CID 46856149
4-hydroxy-5-methoxy-2-oxo-1H-quinoline-3-carboxylic acid
CID 68862785
N-cyclopentyl-4-methoxy-2-methyl-1H-indole-3-carboxamide
CID 110848681
N-acetyl-3-formyl-5-methoxy-4-oxo-1H-quinoline-2-carboxamide
CID 20977871

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2,3-dimethyl-1H-quinolin-4-one?
The IUPAC name of 5-methoxy-2,3-dimethyl-1H-quinolin-4-one (CID 119083522) is 5-methoxy-2,3-dimethyl-1H-quinolin-4-one.
What is the SMILES notation for 5-methoxy-2,3-dimethyl-1H-quinolin-4-one?
The canonical SMILES for 5-methoxy-2,3-dimethyl-1H-quinolin-4-one is COc1cccc2[nH]c(C)c(C)c(=O)c12.
What is the InChIKey of 5-methoxy-2,3-dimethyl-1H-quinolin-4-one?
The InChIKey is NDICKKORDURBPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO2/c1-7-8(2)13-9-5-4-6-10(15-3)11(9)12(7)14/h4-6H,1-3H3,(H,13,14).
What are the key properties of 5-methoxy-2,3-dimethyl-1H-quinolin-4-one?
5-methoxy-2,3-dimethyl-1H-quinolin-4-one has a molecular weight of 203.24 g/mol, XLogP of 2.15, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2,3-dimethyl-1H-quinolin-4-one is sourced from PubChem (CID 119083522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).