3-ethyl-7-methoxy-6-propan-2-yl-1H-quinolin-2-one

C15H19NO2 — CID 154974543

IUPAC3-ethyl-7-methoxy-6-propan-2-yl-1H-quinolin-2-one
SMILESCCc1cc2cc(C(C)C)c(OC)cc2[nH]c1=O
InChIInChI=1S/C15H19NO2/c1-5-10-6-11-7-12(9(2)3)14(18-4)8-13(11)16-15(10)17/h6-9H,5H2,1-4H3,(H,16,17)
InChIKeyYXGIPUHWASQWFU-UHFFFAOYSA-N
MW245.32 g/mol
LogP3.22
Rot. Bonds3

About 3-ethyl-7-methoxy-6-propan-2-yl-1H-quinolin-2-one

3-ethyl-7-methoxy-6-propan-2-yl-1H-quinolin-2-one (PubChem CID 154974543) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is 3-ethyl-7-methoxy-6-propan-2-yl-1H-quinolin-2-one.

Molecular Properties

Compound Name3-ethyl-7-methoxy-6-propan-2-yl-1H-quinolin-2-one
PubChem CID154974543
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC Name3-ethyl-7-methoxy-6-propan-2-yl-1H-quinolin-2-one
SMILESCCc1cc2cc(C(C)C)c(OC)cc2[nH]c1=O
InChIInChI=1S/C15H19NO2/c1-5-10-6-11-7-12(9(2)3)14(18-4)8-13(11)16-15(10)17/h6-9H,5H2,1-4H3,(H,16,17)
InChIKeyYXGIPUHWASQWFU-UHFFFAOYSA-N
XLogP3.22
TPSA42.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-ethyl-7-methoxy-6-propan-2-yl-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

6,7-dimethoxy-3-propan-2-yl-1H-quinolin-2-one
CID 154591387
3-ethyl-6,7-dimethyl-1H-quinolin-2-one
CID 21061119
7-methoxy-3-propan-2-yl-6-(trifluoromethoxy)-1H-quinolin-2-one
CID 154974776
CID 154597526
CID 154597526
N-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylpropanamide
CID 110324984
N-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-ethylbutanamide
CID 110324991
1-ethyl-7-methoxy-6-propan-2-ylnaphthalene
CID 14828144
N-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]propanamide
CID 110324982
3-(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)-N-(2-methylpropyl)propanamide
CID 110298935
7-(2,2-difluoroethoxy)-3-ethyl-2-oxo-1H-quinoline-6-carbonitrile
CID 154974687
3-(anilinomethyl)-6,7-dimethoxy-1H-quinolin-2-one
CID 75527524
3-(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)-N-(3-methylbutyl)propanamide
CID 110298971

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-7-methoxy-6-propan-2-yl-1H-quinolin-2-one?
The IUPAC name of 3-ethyl-7-methoxy-6-propan-2-yl-1H-quinolin-2-one (CID 154974543) is 3-ethyl-7-methoxy-6-propan-2-yl-1H-quinolin-2-one.
What is the SMILES notation for 3-ethyl-7-methoxy-6-propan-2-yl-1H-quinolin-2-one?
The canonical SMILES for 3-ethyl-7-methoxy-6-propan-2-yl-1H-quinolin-2-one is CCc1cc2cc(C(C)C)c(OC)cc2[nH]c1=O.
What is the InChIKey of 3-ethyl-7-methoxy-6-propan-2-yl-1H-quinolin-2-one?
The InChIKey is YXGIPUHWASQWFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c1-5-10-6-11-7-12(9(2)3)14(18-4)8-13(11)16-15(10)17/h6-9H,5H2,1-4H3,(H,16,17).
What are the key properties of 3-ethyl-7-methoxy-6-propan-2-yl-1H-quinolin-2-one?
3-ethyl-7-methoxy-6-propan-2-yl-1H-quinolin-2-one has a molecular weight of 245.32 g/mol, XLogP of 3.22, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-7-methoxy-6-propan-2-yl-1H-quinolin-2-one is sourced from PubChem (CID 154974543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).