3-ethyl-6,7-dimethyl-1H-quinolin-2-one

C13H15NO — CID 21061119

IUPAC3-ethyl-6,7-dimethyl-1H-quinolin-2-one
SMILESCCc1cc2cc(C)c(C)cc2[nH]c1=O
InChIInChI=1S/C13H15NO/c1-4-10-7-11-5-8(2)9(3)6-12(11)14-13(10)15/h5-7H,4H2,1-3H3,(H,14,15)
InChIKeyJDWVFSGPDAXCSM-UHFFFAOYSA-N
MW201.27 g/mol
LogP2.71
Rot. Bonds1

About 3-ethyl-6,7-dimethyl-1H-quinolin-2-one

3-ethyl-6,7-dimethyl-1H-quinolin-2-one (PubChem CID 21061119) has the molecular formula C13H15NO and a molecular weight of 201.27 g/mol. Its IUPAC name is 3-ethyl-6,7-dimethyl-1H-quinolin-2-one.

Molecular Properties

Compound Name3-ethyl-6,7-dimethyl-1H-quinolin-2-one
PubChem CID21061119
Molecular FormulaC13H15NO
Molecular Weight201.27 g/mol
Exact Mass201.12
IUPAC Name3-ethyl-6,7-dimethyl-1H-quinolin-2-one
SMILESCCc1cc2cc(C)c(C)cc2[nH]c1=O
InChIInChI=1S/C13H15NO/c1-4-10-7-11-5-8(2)9(3)6-12(11)14-13(10)15/h5-7H,4H2,1-3H3,(H,14,15)
InChIKeyJDWVFSGPDAXCSM-UHFFFAOYSA-N
XLogP2.71
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3-ethyl-6,7-dimethyl-1H-quinolin-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

3-(ethylaminomethyl)-6,7-dimethyl-1H-quinolin-2-one
CID 23009284
3-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)-N,N-diethylpropanamide
CID 110331658
N-[2-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]acetamide
CID 3240947
3-hydroxy-6,7-dimethyl-1H-quinolin-2-one
CID 177377378
3-ethyl-7-methoxy-6-propan-2-yl-1H-quinolin-2-one
CID 154974543
6-amino-3-ethyl-1H-quinolin-2-one
CID 172552849
3-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)-N-propan-2-ylpropanamide
CID 110331604
methyl 4-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methylamino]-4-oxobutanoate
CID 110662689
1-[2-(dimethylamino)ethyl]-1-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-ethylthiourea
CID 3172564
N-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]pyridine-4-carboxamide
CID 84510401
3-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)-N-prop-2-enylpropanamide
CID 110331606
3-ethyl-2-oxo-1H-quinoline-7-carboxylic acid
CID 59474824

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-6,7-dimethyl-1H-quinolin-2-one?
The IUPAC name of 3-ethyl-6,7-dimethyl-1H-quinolin-2-one (CID 21061119) is 3-ethyl-6,7-dimethyl-1H-quinolin-2-one.
What is the SMILES notation for 3-ethyl-6,7-dimethyl-1H-quinolin-2-one?
The canonical SMILES for 3-ethyl-6,7-dimethyl-1H-quinolin-2-one is CCc1cc2cc(C)c(C)cc2[nH]c1=O.
What is the InChIKey of 3-ethyl-6,7-dimethyl-1H-quinolin-2-one?
The InChIKey is JDWVFSGPDAXCSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO/c1-4-10-7-11-5-8(2)9(3)6-12(11)14-13(10)15/h5-7H,4H2,1-3H3,(H,14,15).
What are the key properties of 3-ethyl-6,7-dimethyl-1H-quinolin-2-one?
3-ethyl-6,7-dimethyl-1H-quinolin-2-one has a molecular weight of 201.27 g/mol, XLogP of 2.71, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-6,7-dimethyl-1H-quinolin-2-one is sourced from PubChem (CID 21061119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).