N-(4-methoxyphenyl)-2-oxo-5-phenylpyrrolidine-3-carboxamide

C18H18N2O3 — CID 168869833

IUPACN-(4-methoxyphenyl)-2-oxo-5-phenylpyrrolidine-3-carboxamide
SMILESCOc1ccc(NC(=O)C2CC(c3ccccc3)NC2=O)cc1
InChIInChI=1S/C18H18N2O3/c1-23-14-9-7-13(8-10-14)19-17(21)15-11-16(20-18(15)22)12-5-3-2-4-6-12/h2-10,15-16H,11H2,1H3,(H,19,21)(H,20,22)
InChIKeyBMJSPTUMDLZDBE-UHFFFAOYSA-N
MW310.35 g/mol
LogP2.51
Rot. Bonds4

About N-(4-methoxyphenyl)-2-oxo-5-phenylpyrrolidine-3-carboxamide

N-(4-methoxyphenyl)-2-oxo-5-phenylpyrrolidine-3-carboxamide (PubChem CID 168869833) has the molecular formula C18H18N2O3 and a molecular weight of 310.35 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-2-oxo-5-phenylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-2-oxo-5-phenylpyrrolidine-3-carboxamide
PubChem CID168869833
Molecular FormulaC18H18N2O3
Molecular Weight310.35 g/mol
Exact Mass310.13
IUPAC NameN-(4-methoxyphenyl)-2-oxo-5-phenylpyrrolidine-3-carboxamide
SMILESCOc1ccc(NC(=O)C2CC(c3ccccc3)NC2=O)cc1
InChIInChI=1S/C18H18N2O3/c1-23-14-9-7-13(8-10-14)19-17(21)15-11-16(20-18(15)22)12-5-3-2-4-6-12/h2-10,15-16H,11H2,1H3,(H,19,21)(H,20,22)
InChIKeyBMJSPTUMDLZDBE-UHFFFAOYSA-N
XLogP2.51
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.35
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

Analyze N-(4-methoxyphenyl)-2-oxo-5-phenylpyrrolidine-3-carboxamide 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

(4S)-N-(4-methoxyphenyl)-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide
CID 51531802
(2S,3R)-N-(4-methoxyphenyl)-1-methyl-6-oxo-2-phenylpiperidine-3-carboxamide
CID 29132160
N-(4-methoxyphenyl)-1-methyl-6-oxo-2-phenylpiperidine-3-carboxamide
CID 42651543
ethane;1H-indazole;N-(4-methoxyphenyl)cyclopropanecarboxamide
CID 166129027
2-[(4-methoxyphenyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 53270389
N-(4-cyclohexyloxyphenyl)-2,4-dioxo-6-phenylpiperidine-3-carboxamide
CID 90897047
N-(4-methoxyphenyl)-5-pyridin-4-ylpyrazolidine-3-carboxamide
CID 75975398
N-(4-methoxyphenyl)-1,2,3,4-tetrahydroquinoxaline-2-carboxamide
CID 107355881
1-acetyl-N-(4-methoxyphenyl)-5-phenylpiperidine-3-carboxamide
CID 42865244
trans-(1S,2S)-2-[(4-methoxyphenyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 774391
(1S,2R,4R,5S)-N-(4-methoxyphenyl)tricyclo[3.2.1.02,4]octane-3-carboxamide
CID 98237630
N-(4-fluorophenyl)-2,4-dioxo-6-phenylpiperidine-3-carboxamide
CID 91538570

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-2-oxo-5-phenylpyrrolidine-3-carboxamide?
The IUPAC name of N-(4-methoxyphenyl)-2-oxo-5-phenylpyrrolidine-3-carboxamide (CID 168869833) is N-(4-methoxyphenyl)-2-oxo-5-phenylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-(4-methoxyphenyl)-2-oxo-5-phenylpyrrolidine-3-carboxamide?
The canonical SMILES for N-(4-methoxyphenyl)-2-oxo-5-phenylpyrrolidine-3-carboxamide is COc1ccc(NC(=O)C2CC(c3ccccc3)NC2=O)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-2-oxo-5-phenylpyrrolidine-3-carboxamide?
The InChIKey is BMJSPTUMDLZDBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O3/c1-23-14-9-7-13(8-10-14)19-17(21)15-11-16(20-18(15)22)12-5-3-2-4-6-12/h2-10,15-16H,11H2,1H3,(H,19,21)(H,20,22).
What are the key properties of N-(4-methoxyphenyl)-2-oxo-5-phenylpyrrolidine-3-carboxamide?
N-(4-methoxyphenyl)-2-oxo-5-phenylpyrrolidine-3-carboxamide has a molecular weight of 310.35 g/mol, XLogP of 2.51, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-2-oxo-5-phenylpyrrolidine-3-carboxamide is sourced from PubChem (CID 168869833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).