6-amino-8-methoxy-4-methyl-1H-quinolin-2-one;ethane

C13H18N2O2 — CID 169247715

IUPAC6-amino-8-methoxy-4-methyl-1H-quinolin-2-one;ethane
SMILESCC.COc1cc(N)cc2c(C)cc(=O)[nH]c12
InChIInChI=1S/C11H12N2O2.C2H6/c1-6-3-10(14)13-11-8(6)4-7(12)5-9(11)15-2;1-2/h3-5H,12H2,1-2H3,(H,13,14);1-2H3
InChIKeyITSOTXWUEMPIIM-UHFFFAOYSA-N
MW234.30 g/mol
LogP2.45
Rot. Bonds1

About 6-amino-8-methoxy-4-methyl-1H-quinolin-2-one;ethane

6-amino-8-methoxy-4-methyl-1H-quinolin-2-one;ethane (PubChem CID 169247715) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is 6-amino-8-methoxy-4-methyl-1H-quinolin-2-one;ethane.

Molecular Properties

Compound Name6-amino-8-methoxy-4-methyl-1H-quinolin-2-one;ethane
PubChem CID169247715
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC Name6-amino-8-methoxy-4-methyl-1H-quinolin-2-one;ethane
SMILESCC.COc1cc(N)cc2c(C)cc(=O)[nH]c12
InChIInChI=1S/C11H12N2O2.C2H6/c1-6-3-10(14)13-11-8(6)4-7(12)5-9(11)15-2;1-2/h3-5H,12H2,1-2H3,(H,13,14);1-2H3
InChIKeyITSOTXWUEMPIIM-UHFFFAOYSA-N
XLogP2.45
TPSA68.11 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 6-amino-8-methoxy-4-methyl-1H-quinolin-2-one;ethane 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

(E)-N-(8-methoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-methyl-4-methylidenehex-2-enamide
CID 169247733
4-methoxy-8-methylnaphthalen-2-amine
CID 105442632
6,8-dimethoxy-4-(trifluoromethyl)-1H-quinolin-2-one
CID 2794452
N-(5,8-dimethoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-2-methylpropanamide
CID 144879713
N-(5,8-dimethoxy-4-methyl-2-oxo-1H-quinolin-6-yl)-3-oxobutanamide
CID 15757685
8-methoxy-2,6-dimethyl-1H-quinolin-4-one
CID 54773037
(4-amino-2,6-dimethoxyphenyl) 2-bromoacetate
CID 169174746
ethane;methane;3-methoxy-4-methylaniline
CID 144516222
6-methoxy-4,5-dimethyl-1H-pyridin-2-one
CID 163918634
ethyl 5-amino-7-methoxy-1H-indole-2-carboxylate
CID 15231750
7-amino-4-methyl-1H-quinolin-2-one;benzene-1,3-diamine
CID 159619510
ethyl 8-(4-methoxyphenyl)-4-methyl-2-oxo-1H-quinoline-6-carboxylate
CID 102087405

Frequently Asked Questions

What is the IUPAC name of 6-amino-8-methoxy-4-methyl-1H-quinolin-2-one;ethane?
The IUPAC name of 6-amino-8-methoxy-4-methyl-1H-quinolin-2-one;ethane (CID 169247715) is 6-amino-8-methoxy-4-methyl-1H-quinolin-2-one;ethane.
What is the SMILES notation for 6-amino-8-methoxy-4-methyl-1H-quinolin-2-one;ethane?
The canonical SMILES for 6-amino-8-methoxy-4-methyl-1H-quinolin-2-one;ethane is CC.COc1cc(N)cc2c(C)cc(=O)[nH]c12.
What is the InChIKey of 6-amino-8-methoxy-4-methyl-1H-quinolin-2-one;ethane?
The InChIKey is ITSOTXWUEMPIIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2.C2H6/c1-6-3-10(14)13-11-8(6)4-7(12)5-9(11)15-2;1-2/h3-5H,12H2,1-2H3,(H,13,14);1-2H3.
What are the key properties of 6-amino-8-methoxy-4-methyl-1H-quinolin-2-one;ethane?
6-amino-8-methoxy-4-methyl-1H-quinolin-2-one;ethane has a molecular weight of 234.30 g/mol, XLogP of 2.45, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-8-methoxy-4-methyl-1H-quinolin-2-one;ethane is sourced from PubChem (CID 169247715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).