5,7-dimethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one

C17H20N2O2 — CID 100744816

IUPAC5,7-dimethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one
SMILESCc1cc(C)c2c(=O)ccn(CC(=O)N3CCCC3)c2c1
InChIInChI=1S/C17H20N2O2/c1-12-9-13(2)17-14(10-12)19(8-5-15(17)20)11-16(21)18-6-3-4-7-18/h5,8-10H,3-4,6-7,11H2,1-2H3
InChIKeyTYJJYHKYJGOKQQ-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.24
Rot. Bonds2

About 5,7-dimethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one

5,7-dimethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one (PubChem CID 100744816) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 5,7-dimethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one.

Molecular Properties

Compound Name5,7-dimethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one
PubChem CID100744816
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name5,7-dimethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one
SMILESCc1cc(C)c2c(=O)ccn(CC(=O)N3CCCC3)c2c1
InChIInChI=1S/C17H20N2O2/c1-12-9-13(2)17-14(10-12)19(8-5-15(17)20)11-16(21)18-6-3-4-7-18/h5,8-10H,3-4,6-7,11H2,1-2H3
InChIKeyTYJJYHKYJGOKQQ-UHFFFAOYSA-N
XLogP2.24
TPSA42.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 5,7-dimethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-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

1-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-5,7-dimethylquinolin-4-one
CID 100745064
6-methyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one
CID 100742023
N-tert-butyl-2-(5,7-dimethyl-4-oxoquinolin-1-yl)acetamide
CID 100744049
2-(5,7-dimethyl-4-oxoquinolin-1-yl)-N-(4-fluorophenyl)acetamide
CID 100744381
N-benzyl-2-(5,7-dimethyl-4-oxoquinolin-1-yl)-N-methylacetamide
CID 100744798
1-[2-(azepan-1-yl)-2-oxoethyl]-6-fluoroquinolin-4-one
CID 100743617
2-(5,7-dimethyl-4-oxoquinolin-1-yl)-N-(pyridin-4-ylmethyl)acetamide
CID 100744235
2-oxo-1-(2-oxo-2-piperidin-1-ylethyl)pyridine-4-carboxylic acid
CID 82902984
2-indol-1-yl-1-pyrrolidin-1-ylethanone
CID 5191246
2-(6-methylindol-1-yl)-1-(4-methylpiperazin-1-yl)ethanone
CID 116546775
1-[2-(5-methylindol-1-yl)acetyl]piperidin-4-one
CID 63555836
ethyl 1-[2-(6-methyl-4-oxoquinolin-1-yl)acetyl]piperidine-4-carboxylate
CID 100742059

Frequently Asked Questions

What is the IUPAC name of 5,7-dimethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one?
The IUPAC name of 5,7-dimethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one (CID 100744816) is 5,7-dimethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one.
What is the SMILES notation for 5,7-dimethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one?
The canonical SMILES for 5,7-dimethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one is Cc1cc(C)c2c(=O)ccn(CC(=O)N3CCCC3)c2c1.
What is the InChIKey of 5,7-dimethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one?
The InChIKey is TYJJYHKYJGOKQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-12-9-13(2)17-14(10-12)19(8-5-15(17)20)11-16(21)18-6-3-4-7-18/h5,8-10H,3-4,6-7,11H2,1-2H3.
What are the key properties of 5,7-dimethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one?
5,7-dimethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one has a molecular weight of 284.36 g/mol, XLogP of 2.24, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dimethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-4-one is sourced from PubChem (CID 100744816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).