1-(2-amino-1-cyclopentylethyl)-3-phenylpyrrolidine-2,5-dione

C17H22N2O2 — CID 106738385

IUPAC1-(2-amino-1-cyclopentylethyl)-3-phenylpyrrolidine-2,5-dione
SMILESNCC(C1CCCC1)N1C(=O)CC(c2ccccc2)C1=O
InChIInChI=1S/C17H22N2O2/c18-11-15(13-8-4-5-9-13)19-16(20)10-14(17(19)21)12-6-2-1-3-7-12/h1-3,6-7,13-15H,4-5,8-11,18H2
InChIKeyXTCAYAAHEKBCLG-UHFFFAOYSA-N
MW286.37 g/mol
LogP2.05
Rot. Bonds4

About 1-(2-amino-1-cyclopentylethyl)-3-phenylpyrrolidine-2,5-dione

1-(2-amino-1-cyclopentylethyl)-3-phenylpyrrolidine-2,5-dione (PubChem CID 106738385) has the molecular formula C17H22N2O2 and a molecular weight of 286.37 g/mol. Its IUPAC name is 1-(2-amino-1-cyclopentylethyl)-3-phenylpyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-(2-amino-1-cyclopentylethyl)-3-phenylpyrrolidine-2,5-dione
PubChem CID106738385
Molecular FormulaC17H22N2O2
Molecular Weight286.37 g/mol
Exact Mass286.17
IUPAC Name1-(2-amino-1-cyclopentylethyl)-3-phenylpyrrolidine-2,5-dione
SMILESNCC(C1CCCC1)N1C(=O)CC(c2ccccc2)C1=O
InChIInChI=1S/C17H22N2O2/c18-11-15(13-8-4-5-9-13)19-16(20)10-14(17(19)21)12-6-2-1-3-7-12/h1-3,6-7,13-15H,4-5,8-11,18H2
InChIKeyXTCAYAAHEKBCLG-UHFFFAOYSA-N
XLogP2.05
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.37
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

1-[(1R,2R)-2-aminocyclohexyl]-3-phenylpyrrolidine-2,5-dione
CID 102738905
1-(4-hydroxy-3-methylsulfanylbutan-2-yl)-3-phenylpyrrolidine-2,5-dione
CID 106159464
5-(2,5-dioxo-3-phenylpyrrolidin-1-yl)hexanoic acid
CID 82846688
2-(2,5-dioxo-3-phenylpyrrolidin-1-yl)cyclopentane-1-carbothioamide
CID 62955894
1-[5-(aminomethyl)-2-pyridinyl]-3-phenylpyrrolidine-2,5-dione
CID 62354535
2-(2-amino-1-cyclopropylethyl)-4H-isoquinoline-1,3-dione
CID 65193492
1-(4-aminocyclohexyl)-3-phenylpyrrolidine-2,5-dione
CID 61209256
1-(2-amino-1-cyclopropylethyl)pyrrole-2,5-dione
CID 65194125
1-(2-bromophenyl)-3-phenylpyrrolidine-2,5-dione
CID 60703087
1-(2-chlorophenyl)-3-phenylpyrrolidine-2,5-dione
CID 121238704
1-(3-amino-5-fluorophenyl)-3-phenylpyrrolidine-2,5-dione
CID 107334803
1-(5-amino-2-pyridinyl)-3-phenylpyrrolidine-2,5-dione
CID 62881401

Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-1-cyclopentylethyl)-3-phenylpyrrolidine-2,5-dione?
The IUPAC name of 1-(2-amino-1-cyclopentylethyl)-3-phenylpyrrolidine-2,5-dione (CID 106738385) is 1-(2-amino-1-cyclopentylethyl)-3-phenylpyrrolidine-2,5-dione.
What is the SMILES notation for 1-(2-amino-1-cyclopentylethyl)-3-phenylpyrrolidine-2,5-dione?
The canonical SMILES for 1-(2-amino-1-cyclopentylethyl)-3-phenylpyrrolidine-2,5-dione is NCC(C1CCCC1)N1C(=O)CC(c2ccccc2)C1=O.
What is the InChIKey of 1-(2-amino-1-cyclopentylethyl)-3-phenylpyrrolidine-2,5-dione?
The InChIKey is XTCAYAAHEKBCLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2/c18-11-15(13-8-4-5-9-13)19-16(20)10-14(17(19)21)12-6-2-1-3-7-12/h1-3,6-7,13-15H,4-5,8-11,18H2.
What are the key properties of 1-(2-amino-1-cyclopentylethyl)-3-phenylpyrrolidine-2,5-dione?
1-(2-amino-1-cyclopentylethyl)-3-phenylpyrrolidine-2,5-dione has a molecular weight of 286.37 g/mol, XLogP of 2.05, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-1-cyclopentylethyl)-3-phenylpyrrolidine-2,5-dione is sourced from PubChem (CID 106738385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).