1-(4-chlorophenyl)-3,4-diphenylpyrrolidine-2,5-dione

C22H16ClNO2 — CID 71556473

IUPAC1-(4-chlorophenyl)-3,4-diphenylpyrrolidine-2,5-dione
SMILESO=C1C(c2ccccc2)C(c2ccccc2)C(=O)N1c1ccc(Cl)cc1
InChIInChI=1S/C22H16ClNO2/c23-17-11-13-18(14-12-17)24-21(25)19(15-7-3-1-4-8-15)20(22(24)26)16-9-5-2-6-10-16/h1-14,19-20H
InChIKeyFWSPABWMBYWPOA-UHFFFAOYSA-N
MW361.83 g/mol
LogP4.78
Rot. Bonds3

About 1-(4-chlorophenyl)-3,4-diphenylpyrrolidine-2,5-dione

1-(4-chlorophenyl)-3,4-diphenylpyrrolidine-2,5-dione (PubChem CID 71556473) has the molecular formula C22H16ClNO2 and a molecular weight of 361.83 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-3,4-diphenylpyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-(4-chlorophenyl)-3,4-diphenylpyrrolidine-2,5-dione
PubChem CID71556473
Molecular FormulaC22H16ClNO2
Molecular Weight361.83 g/mol
Exact Mass361.09
IUPAC Name1-(4-chlorophenyl)-3,4-diphenylpyrrolidine-2,5-dione
SMILESO=C1C(c2ccccc2)C(c2ccccc2)C(=O)N1c1ccc(Cl)cc1
InChIInChI=1S/C22H16ClNO2/c23-17-11-13-18(14-12-17)24-21(25)19(15-7-3-1-4-8-15)20(22(24)26)16-9-5-2-6-10-16/h1-14,19-20H
InChIKeyFWSPABWMBYWPOA-UHFFFAOYSA-N
XLogP4.78
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.83
LogP ≤ 54.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-(4-chlorophenyl)-3,4-diphenylpyrrolidine-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

Related Compounds

Phthalimide, N-(p-chlorophenyl)-
CID 81867
2-(3-chloro-4-methylphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione
CID 2873125
1-Phenyl-3-(1-phenylethyl)pyrrolidine-2,5-dione
CID 2865487
2-(2,4-dichlorophenyl)-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione
CID 3120450
3-(4-Chlorophenyl)-1,6,6-triphenyl-3-azabicyclo[3.1.0]hexane-2,4-dione
CID 4593075
3-Benzyl-1-(3,5-dichloro-phenyl)-3-methyl-1,3-dihydro-indol-2-one
CID 9800103
N-(4-chlorophenyl)-2-(4-phenylcyclohexyl)acetamide
CID 121325203
1-(4-Tert-butylphenyl)-3-phenylpyrrolidine-2,5-dione
CID 2825989
Succinimide, 2-benzyl-N-phenyl-
CID 622117
2-(3-chlorophenyl)hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione
CID 561782
2-(3-Chlorophenyl)-3a,3b,4,5,6,7,8,9,9a,9b-decahydro-as-indaceno[4,5-c]pyrrole-1,3-dione
CID 2873248
N-(4-chlorophenyl)-3-(5-methyl-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)benzamide
CID 2905188

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-3,4-diphenylpyrrolidine-2,5-dione?
The IUPAC name of 1-(4-chlorophenyl)-3,4-diphenylpyrrolidine-2,5-dione (CID 71556473) is 1-(4-chlorophenyl)-3,4-diphenylpyrrolidine-2,5-dione.
What is the SMILES notation for 1-(4-chlorophenyl)-3,4-diphenylpyrrolidine-2,5-dione?
The canonical SMILES for 1-(4-chlorophenyl)-3,4-diphenylpyrrolidine-2,5-dione is O=C1C(c2ccccc2)C(c2ccccc2)C(=O)N1c1ccc(Cl)cc1.
What is the InChIKey of 1-(4-chlorophenyl)-3,4-diphenylpyrrolidine-2,5-dione?
The InChIKey is FWSPABWMBYWPOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16ClNO2/c23-17-11-13-18(14-12-17)24-21(25)19(15-7-3-1-4-8-15)20(22(24)26)16-9-5-2-6-10-16/h1-14,19-20H.
What are the key properties of 1-(4-chlorophenyl)-3,4-diphenylpyrrolidine-2,5-dione?
1-(4-chlorophenyl)-3,4-diphenylpyrrolidine-2,5-dione has a molecular weight of 361.83 g/mol, XLogP of 4.78, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-3,4-diphenylpyrrolidine-2,5-dione is sourced from PubChem (CID 71556473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).