1-[4-(1-cyclopentylethylamino)phenyl]pyrrolidin-2-one

C17H24N2O — CID 62632450

IUPAC1-[4-(1-cyclopentylethylamino)phenyl]pyrrolidin-2-one
SMILESCC(Nc1ccc(N2CCCC2=O)cc1)C1CCCC1
InChIInChI=1S/C17H24N2O/c1-13(14-5-2-3-6-14)18-15-8-10-16(11-9-15)19-12-4-7-17(19)20/h8-11,13-14,18H,2-7,12H2,1H3
InChIKeyBXWPZIRVOZUADD-UHFFFAOYSA-N
MW272.39 g/mol
LogP3.80
Rot. Bonds4

About 1-[4-(1-cyclopentylethylamino)phenyl]pyrrolidin-2-one

1-[4-(1-cyclopentylethylamino)phenyl]pyrrolidin-2-one (PubChem CID 62632450) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is 1-[4-(1-cyclopentylethylamino)phenyl]pyrrolidin-2-one.

Molecular Properties

Compound Name1-[4-(1-cyclopentylethylamino)phenyl]pyrrolidin-2-one
PubChem CID62632450
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC Name1-[4-(1-cyclopentylethylamino)phenyl]pyrrolidin-2-one
SMILESCC(Nc1ccc(N2CCCC2=O)cc1)C1CCCC1
InChIInChI=1S/C17H24N2O/c1-13(14-5-2-3-6-14)18-15-8-10-16(11-9-15)19-12-4-7-17(19)20/h8-11,13-14,18H,2-7,12H2,1H3
InChIKeyBXWPZIRVOZUADD-UHFFFAOYSA-N
XLogP3.80
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-[4-(1-cyclopentylethylamino)phenyl]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-[4-[1-(oxolan-3-yl)ethylamino]phenyl]pyrrolidin-2-one
CID 115917242
1-[4-(1-cyclopentylethylamino)phenyl]imidazolidin-2-one
CID 62631563
1-[4-(methylamino)phenyl]pyrrolidin-2-one
CID 54310012
1-[4-(1-pyridin-4-ylethylamino)phenyl]pyrrolidin-2-one
CID 43679644
1-[4-(2-oxopyrrolidin-1-yl)phenyl]pyrrolidin-2-one
CID 822790
1-[4-(2-methylpropylamino)phenyl]pyrrolidin-2-one
CID 43679619
1-[4-(hexan-3-ylamino)phenyl]pyrrolidin-2-one
CID 103930966
1-[4-[[1-(2-ethylpiperidin-1-yl)-1-oxopropan-2-yl]amino]phenyl]pyrrolidin-2-one
CID 78788446
1-[3-[1-(oxolan-3-yl)ethylamino]phenyl]pyrrolidin-2-one
CID 115917292
1-[4-(oxepan-4-ylamino)phenyl]pyrrolidin-2-one
CID 65081475
N-cyclopentyl-N'-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide
CID 30679166
1-[4-[(2-methoxycyclohexyl)amino]phenyl]pyrrolidin-2-one
CID 43780088

Frequently Asked Questions

What is the IUPAC name of 1-[4-(1-cyclopentylethylamino)phenyl]pyrrolidin-2-one?
The IUPAC name of 1-[4-(1-cyclopentylethylamino)phenyl]pyrrolidin-2-one (CID 62632450) is 1-[4-(1-cyclopentylethylamino)phenyl]pyrrolidin-2-one.
What is the SMILES notation for 1-[4-(1-cyclopentylethylamino)phenyl]pyrrolidin-2-one?
The canonical SMILES for 1-[4-(1-cyclopentylethylamino)phenyl]pyrrolidin-2-one is CC(Nc1ccc(N2CCCC2=O)cc1)C1CCCC1.
What is the InChIKey of 1-[4-(1-cyclopentylethylamino)phenyl]pyrrolidin-2-one?
The InChIKey is BXWPZIRVOZUADD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O/c1-13(14-5-2-3-6-14)18-15-8-10-16(11-9-15)19-12-4-7-17(19)20/h8-11,13-14,18H,2-7,12H2,1H3.
What are the key properties of 1-[4-(1-cyclopentylethylamino)phenyl]pyrrolidin-2-one?
1-[4-(1-cyclopentylethylamino)phenyl]pyrrolidin-2-one has a molecular weight of 272.39 g/mol, XLogP of 3.80, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(1-cyclopentylethylamino)phenyl]pyrrolidin-2-one is sourced from PubChem (CID 62632450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).