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

C18H17NO2 — CID 2865487

IUPAC1-phenyl-3-(1-phenylethyl)pyrrolidine-2,5-dione
SMILESCC(c1ccccc1)C1CC(=O)N(c2ccccc2)C1=O
InChIInChI=1S/C18H17NO2/c1-13(14-8-4-2-5-9-14)16-12-17(20)19(18(16)21)15-10-6-3-7-11-15/h2-11,13,16H,12H2,1H3
InChIKeyPUKRDCGVHPWFQD-UHFFFAOYSA-N
MW279.34 g/mol
LogP3.37
Rot. Bonds3

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

1-phenyl-3-(1-phenylethyl)pyrrolidine-2,5-dione (PubChem CID 2865487) has the molecular formula C18H17NO2 and a molecular weight of 279.34 g/mol. Its IUPAC name is 1-phenyl-3-(1-phenylethyl)pyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-phenyl-3-(1-phenylethyl)pyrrolidine-2,5-dione
PubChem CID2865487
Molecular FormulaC18H17NO2
Molecular Weight279.34 g/mol
Exact Mass279.13
IUPAC Name1-phenyl-3-(1-phenylethyl)pyrrolidine-2,5-dione
SMILESCC(c1ccccc1)C1CC(=O)N(c2ccccc2)C1=O
InChIInChI=1S/C18H17NO2/c1-13(14-8-4-2-5-9-14)16-12-17(20)19(18(16)21)15-10-6-3-7-11-15/h2-11,13,16H,12H2,1H3
InChIKeyPUKRDCGVHPWFQD-UHFFFAOYSA-N
XLogP3.37
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-phenyl-3-(1-phenylethyl)pyrrolidine-2,5-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-3-(1-phenylethyl)pyrrolidine-2,5-dione?
The IUPAC name of 1-phenyl-3-(1-phenylethyl)pyrrolidine-2,5-dione (CID 2865487) is 1-phenyl-3-(1-phenylethyl)pyrrolidine-2,5-dione.
What is the SMILES notation for 1-phenyl-3-(1-phenylethyl)pyrrolidine-2,5-dione?
The canonical SMILES for 1-phenyl-3-(1-phenylethyl)pyrrolidine-2,5-dione is CC(c1ccccc1)C1CC(=O)N(c2ccccc2)C1=O.
What is the InChIKey of 1-phenyl-3-(1-phenylethyl)pyrrolidine-2,5-dione?
The InChIKey is PUKRDCGVHPWFQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17NO2/c1-13(14-8-4-2-5-9-14)16-12-17(20)19(18(16)21)15-10-6-3-7-11-15/h2-11,13,16H,12H2,1H3.
What are the key properties of 1-phenyl-3-(1-phenylethyl)pyrrolidine-2,5-dione?
1-phenyl-3-(1-phenylethyl)pyrrolidine-2,5-dione has a molecular weight of 279.34 g/mol, XLogP of 3.37, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-3-(1-phenylethyl)pyrrolidine-2,5-dione is sourced from PubChem (CID 2865487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).