1-(2-ethoxyphenyl)-4-(piperazine-1-carbonyl)pyrrolidin-2-one

C17H23N3O3 — CID 119402096

IUPAC1-(2-ethoxyphenyl)-4-(piperazine-1-carbonyl)pyrrolidin-2-one
SMILESCCOc1ccccc1N1CC(C(=O)N2CCNCC2)CC1=O
InChIInChI=1S/C17H23N3O3/c1-2-23-15-6-4-3-5-14(15)20-12-13(11-16(20)21)17(22)19-9-7-18-8-10-19/h3-6,13,18H,2,7-12H2,1H3
InChIKeyZZTYEJFXIZMJGN-UHFFFAOYSA-N
MW317.39 g/mol
LogP0.87
Rot. Bonds4

About 1-(2-ethoxyphenyl)-4-(piperazine-1-carbonyl)pyrrolidin-2-one

1-(2-ethoxyphenyl)-4-(piperazine-1-carbonyl)pyrrolidin-2-one (PubChem CID 119402096) has the molecular formula C17H23N3O3 and a molecular weight of 317.39 g/mol. Its IUPAC name is 1-(2-ethoxyphenyl)-4-(piperazine-1-carbonyl)pyrrolidin-2-one.

Molecular Properties

Compound Name1-(2-ethoxyphenyl)-4-(piperazine-1-carbonyl)pyrrolidin-2-one
PubChem CID119402096
Molecular FormulaC17H23N3O3
Molecular Weight317.39 g/mol
Exact Mass317.17
IUPAC Name1-(2-ethoxyphenyl)-4-(piperazine-1-carbonyl)pyrrolidin-2-one
SMILESCCOc1ccccc1N1CC(C(=O)N2CCNCC2)CC1=O
InChIInChI=1S/C17H23N3O3/c1-2-23-15-6-4-3-5-14(15)20-12-13(11-16(20)21)17(22)19-9-7-18-8-10-19/h3-6,13,18H,2,7-12H2,1H3
InChIKeyZZTYEJFXIZMJGN-UHFFFAOYSA-N
XLogP0.87
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(2-ethoxyphenyl)-4-(piperazine-1-carbonyl)pyrrolidin-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

1-(2-ethoxyphenyl)-4-[4-(4-methylpiperazine-1-carbonyl)piperidine-1-carbonyl]pyrrolidin-2-one
CID 55717950
(4R)-4-[4-(2-ethoxyphenyl)piperazine-1-carbonyl]-1-(2-ethylphenyl)pyrrolidin-2-one
CID 9415361
(4R)-1-(2-ethoxyphenyl)-4-(4-pyridin-4-ylpiperazine-1-carbonyl)pyrrolidin-2-one
CID 9254687
6-[1-(2-ethoxyphenyl)-5-oxopyrrolidine-3-carbonyl]-6-azaspiro[2.5]octane-2-carboxylic acid
CID 119137349
1-(2-methylphenyl)-4-(piperazine-1-carbonyl)pyrrolidin-2-one;hydrate;hydrochloride
CID 21128885
(4S)-4-(2,3-dihydroindole-1-carbonyl)-1-(2-ethoxyphenyl)pyrrolidin-2-one
CID 2516185
2-[4-[1-(2-ethoxyphenyl)-5-oxopyrrolidine-3-carbonyl]-1,4-diazepan-1-yl]-N,N-diethylacetamide
CID 55603098
1-(2-fluorophenyl)-4-(piperazine-1-carbonyl)pyrrolidin-2-one
CID 42650970
4-[4-(2-ethoxyphenyl)piperazine-1-carbonyl]-1-methylpyrrolidin-2-one
CID 75460850
1-(2-ethoxyphenyl)-N,N-diethyl-5-oxopyrrolidine-3-carboxamide
CID 18886165
1-(2-ethoxyphenyl)-4-[2-(1-methylimidazol-2-yl)piperazine-1-carbonyl]pyrrolidin-2-one;hydrochloride
CID 120880661
(2R)-1-[1-(2-ethoxyphenyl)-5-oxopyrrolidine-3-carbonyl]pyrrolidine-2-carboxylic acid
CID 119371077

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxyphenyl)-4-(piperazine-1-carbonyl)pyrrolidin-2-one?
The IUPAC name of 1-(2-ethoxyphenyl)-4-(piperazine-1-carbonyl)pyrrolidin-2-one (CID 119402096) is 1-(2-ethoxyphenyl)-4-(piperazine-1-carbonyl)pyrrolidin-2-one.
What is the SMILES notation for 1-(2-ethoxyphenyl)-4-(piperazine-1-carbonyl)pyrrolidin-2-one?
The canonical SMILES for 1-(2-ethoxyphenyl)-4-(piperazine-1-carbonyl)pyrrolidin-2-one is CCOc1ccccc1N1CC(C(=O)N2CCNCC2)CC1=O.
What is the InChIKey of 1-(2-ethoxyphenyl)-4-(piperazine-1-carbonyl)pyrrolidin-2-one?
The InChIKey is ZZTYEJFXIZMJGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O3/c1-2-23-15-6-4-3-5-14(15)20-12-13(11-16(20)21)17(22)19-9-7-18-8-10-19/h3-6,13,18H,2,7-12H2,1H3.
What are the key properties of 1-(2-ethoxyphenyl)-4-(piperazine-1-carbonyl)pyrrolidin-2-one?
1-(2-ethoxyphenyl)-4-(piperazine-1-carbonyl)pyrrolidin-2-one has a molecular weight of 317.39 g/mol, XLogP of 0.87, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxyphenyl)-4-(piperazine-1-carbonyl)pyrrolidin-2-one is sourced from PubChem (CID 119402096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).