3-(4-methylanilino)-1-(2-phenylethyl)pyrrolidine-2,5-dione

C19H20N2O2 — CID 2974011

IUPAC3-(4-methylanilino)-1-(2-phenylethyl)pyrrolidine-2,5-dione
SMILESCc1ccc(NC2CC(=O)N(CCc3ccccc3)C2=O)cc1
InChIInChI=1S/C19H20N2O2/c1-14-7-9-16(10-8-14)20-17-13-18(22)21(19(17)23)12-11-15-5-3-2-4-6-15/h2-10,17,20H,11-13H2,1H3
InChIKeyAQZPIVMASFAHQG-UHFFFAOYSA-N
MW308.38 g/mol
LogP2.78
Rot. Bonds5

About 3-(4-methylanilino)-1-(2-phenylethyl)pyrrolidine-2,5-dione

3-(4-methylanilino)-1-(2-phenylethyl)pyrrolidine-2,5-dione (PubChem CID 2974011) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is 3-(4-methylanilino)-1-(2-phenylethyl)pyrrolidine-2,5-dione.

Molecular Properties

Compound Name3-(4-methylanilino)-1-(2-phenylethyl)pyrrolidine-2,5-dione
PubChem CID2974011
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC Name3-(4-methylanilino)-1-(2-phenylethyl)pyrrolidine-2,5-dione
SMILESCc1ccc(NC2CC(=O)N(CCc3ccccc3)C2=O)cc1
InChIInChI=1S/C19H20N2O2/c1-14-7-9-16(10-8-14)20-17-13-18(22)21(19(17)23)12-11-15-5-3-2-4-6-15/h2-10,17,20H,11-13H2,1H3
InChIKeyAQZPIVMASFAHQG-UHFFFAOYSA-N
XLogP2.78
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 3-(4-methylanilino)-1-(2-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

Related Compounds

2-(1,3-Dioxo-1,3-dihydro-isoindol-2-YL)-N-P-tolyl-acetamide
CID 344672
1-cyclohexyl-N-(2,5-dimethylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 2844150
6-Ammonio-N-(Trifluoroacetyl)-L-Norleucyl-N-[4-(1-Methylethyl)phenyl]-L-Prolinamide
CID 445368
2-(4-Amino-phenyl)-N-methyl-N-((S)-1-phenyl-2-pyrrolidin-1-yl-ethyl)-acetamide
CID 9997232
1-[2-oxo-2-(2,2,4-trimethyl-1(2H)-quinolinyl)ethyl]-2,5-pyrrolidinedione
CID 713603
4-acetyl-7-methyl-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one
CID 2862158
3-[(4-Fluorophenyl)methylamino]-1-phenylpyrrolidine-2,5-dione
CID 2877115
2-(2,5-dioxoimidazolidin-1-yl)-N-(p-tolyl)acetamide
CID 2162395
N'-(4-methylphenyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)oxamide
CID 3107635
Iem 611
CID 39794
1-Benzyl-3-(hydroxyanilino)-2,5-pyrrolidinedione
CID 2837843
1-Benzyl-3-(4-(4-morpholinyl)anilino)-2,5-pyrrolidinedione
CID 2861706

Frequently Asked Questions

What is the IUPAC name of 3-(4-methylanilino)-1-(2-phenylethyl)pyrrolidine-2,5-dione?
The IUPAC name of 3-(4-methylanilino)-1-(2-phenylethyl)pyrrolidine-2,5-dione (CID 2974011) is 3-(4-methylanilino)-1-(2-phenylethyl)pyrrolidine-2,5-dione.
What is the SMILES notation for 3-(4-methylanilino)-1-(2-phenylethyl)pyrrolidine-2,5-dione?
The canonical SMILES for 3-(4-methylanilino)-1-(2-phenylethyl)pyrrolidine-2,5-dione is Cc1ccc(NC2CC(=O)N(CCc3ccccc3)C2=O)cc1.
What is the InChIKey of 3-(4-methylanilino)-1-(2-phenylethyl)pyrrolidine-2,5-dione?
The InChIKey is AQZPIVMASFAHQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c1-14-7-9-16(10-8-14)20-17-13-18(22)21(19(17)23)12-11-15-5-3-2-4-6-15/h2-10,17,20H,11-13H2,1H3.
What are the key properties of 3-(4-methylanilino)-1-(2-phenylethyl)pyrrolidine-2,5-dione?
3-(4-methylanilino)-1-(2-phenylethyl)pyrrolidine-2,5-dione has a molecular weight of 308.38 g/mol, XLogP of 2.78, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methylanilino)-1-(2-phenylethyl)pyrrolidine-2,5-dione is sourced from PubChem (CID 2974011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).