1-(2-phenylethyl)-3-(2-phenylethylamino)pyrrolidine-2,5-dione

C20H22N2O2 — CID 2853912

IUPAC1-(2-phenylethyl)-3-(2-phenylethylamino)pyrrolidine-2,5-dione
SMILESO=C1CC(NCCc2ccccc2)C(=O)N1CCc1ccccc1
InChIInChI=1S/C20H22N2O2/c23-19-15-18(21-13-11-16-7-3-1-4-8-16)20(24)22(19)14-12-17-9-5-2-6-10-17/h1-10,18,21H,11-15H2
InChIKeyWNIARGDFPKEWGV-UHFFFAOYSA-N
MW322.41 g/mol
LogP2.19
Rot. Bonds7

About 1-(2-phenylethyl)-3-(2-phenylethylamino)pyrrolidine-2,5-dione

1-(2-phenylethyl)-3-(2-phenylethylamino)pyrrolidine-2,5-dione (PubChem CID 2853912) has the molecular formula C20H22N2O2 and a molecular weight of 322.41 g/mol. Its IUPAC name is 1-(2-phenylethyl)-3-(2-phenylethylamino)pyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-(2-phenylethyl)-3-(2-phenylethylamino)pyrrolidine-2,5-dione
PubChem CID2853912
Molecular FormulaC20H22N2O2
Molecular Weight322.41 g/mol
Exact Mass322.17
IUPAC Name1-(2-phenylethyl)-3-(2-phenylethylamino)pyrrolidine-2,5-dione
SMILESO=C1CC(NCCc2ccccc2)C(=O)N1CCc1ccccc1
InChIInChI=1S/C20H22N2O2/c23-19-15-18(21-13-11-16-7-3-1-4-8-16)20(24)22(19)14-12-17-9-5-2-6-10-17/h1-10,18,21H,11-15H2
InChIKeyWNIARGDFPKEWGV-UHFFFAOYSA-N
XLogP2.19
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 52.19
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

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BN-201
CID 66610682
(2S)-N-[(1S)-1-(4-aminocyclohexyl)-3-(methylamino)-2,3-dioxopropyl]-1-[(2R)-2-(methylamino)-3-phenylpropanoyl]pyrrolidine-2-carboxamide
CID 10322542
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CID 85169
(D)-Phe-(D)-Phe-NH2
CID 7037588
(L)-Phe-(D)-Phe-NH2
CID 7088460
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CID 10178009

Frequently Asked Questions

What is the IUPAC name of 1-(2-phenylethyl)-3-(2-phenylethylamino)pyrrolidine-2,5-dione?
The IUPAC name of 1-(2-phenylethyl)-3-(2-phenylethylamino)pyrrolidine-2,5-dione (CID 2853912) is 1-(2-phenylethyl)-3-(2-phenylethylamino)pyrrolidine-2,5-dione.
What is the SMILES notation for 1-(2-phenylethyl)-3-(2-phenylethylamino)pyrrolidine-2,5-dione?
The canonical SMILES for 1-(2-phenylethyl)-3-(2-phenylethylamino)pyrrolidine-2,5-dione is O=C1CC(NCCc2ccccc2)C(=O)N1CCc1ccccc1.
What is the InChIKey of 1-(2-phenylethyl)-3-(2-phenylethylamino)pyrrolidine-2,5-dione?
The InChIKey is WNIARGDFPKEWGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O2/c23-19-15-18(21-13-11-16-7-3-1-4-8-16)20(24)22(19)14-12-17-9-5-2-6-10-17/h1-10,18,21H,11-15H2.
What are the key properties of 1-(2-phenylethyl)-3-(2-phenylethylamino)pyrrolidine-2,5-dione?
1-(2-phenylethyl)-3-(2-phenylethylamino)pyrrolidine-2,5-dione has a molecular weight of 322.41 g/mol, XLogP of 2.19, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-phenylethyl)-3-(2-phenylethylamino)pyrrolidine-2,5-dione is sourced from PubChem (CID 2853912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).