(3S)-3-acetamido-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-3-phenylpropanamide

C21H23N3O3 — CID 97027799

IUPAC(3S)-3-acetamido-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-3-phenylpropanamide
SMILESCC(=O)N[C@@H](CC(=O)N[C@H]1CC(=O)N(c2ccccc2)C1)c1ccccc1
InChIInChI=1S/C21H23N3O3/c1-15(25)22-19(16-8-4-2-5-9-16)13-20(26)23-17-12-21(27)24(14-17)18-10-6-3-7-11-18/h2-11,17,19H,12-14H2,1H3,(H,22,25)(H,23,26)/t17-,19-/m0/s1
InChIKeyXTWNGZCESBNMAG-HKUYNNGSSA-N
MW365.43 g/mol
LogP2.18
Rot. Bonds6

About (3S)-3-acetamido-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-3-phenylpropanamide

(3S)-3-acetamido-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-3-phenylpropanamide (PubChem CID 97027799) has the molecular formula C21H23N3O3 and a molecular weight of 365.43 g/mol. Its IUPAC name is (3S)-3-acetamido-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-3-phenylpropanamide.

Molecular Properties

Compound Name(3S)-3-acetamido-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-3-phenylpropanamide
PubChem CID97027799
Molecular FormulaC21H23N3O3
Molecular Weight365.43 g/mol
Exact Mass365.17
IUPAC Name(3S)-3-acetamido-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-3-phenylpropanamide
SMILESCC(=O)N[C@@H](CC(=O)N[C@H]1CC(=O)N(c2ccccc2)C1)c1ccccc1
InChIInChI=1S/C21H23N3O3/c1-15(25)22-19(16-8-4-2-5-9-16)13-20(26)23-17-12-21(27)24(14-17)18-10-6-3-7-11-18/h2-11,17,19H,12-14H2,1H3,(H,22,25)(H,23,26)/t17-,19-/m0/s1
InChIKeyXTWNGZCESBNMAG-HKUYNNGSSA-N
XLogP2.18
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.43
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (3S)-3-acetamido-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-3-phenylpropanamide 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

N-[(3R)-5-oxo-1-phenylpyrrolidin-3-yl]-3,3-diphenylpropanamide
CID 7546964
(3S)-3-acetamido-N-cyclopropyl-3-phenylpropanamide
CID 9165607
N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]butanamide
CID 7546570
methyl 4-oxo-4-[(5-oxo-1-phenylpyrrolidin-3-yl)amino]butanoate
CID 110736807
N-[(3R)-1-(3,4-dimethoxyphenyl)-5-oxopyrrolidin-3-yl]-3,3-diphenylpropanamide
CID 41152252
(2R)-2-amino-N-(5-oxo-1-phenylpyrrolidin-3-yl)propanamide
CID 119305747
2-(4-ethoxyphenoxy)-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]acetamide
CID 7546892
1,1-dimethyl-3-(5-oxo-1-phenylpyrrolidin-3-yl)urea
CID 18564044
2-(4-fluorophenyl)-N-[(3R)-5-oxo-1-phenylpyrrolidin-3-yl]acetamide
CID 7254979
2-(4-methoxyphenyl)-N-[(3R)-5-oxo-1-phenylpyrrolidin-3-yl]acetamide
CID 7546938
N-[(3R)-1-(4-chlorophenyl)-5-oxopyrrolidin-3-yl]-3-methylbutanamide
CID 7255518
N-(5-oxo-1-phenylpyrrolidin-3-yl)-3-phenoxypropanamide
CID 110736812

Frequently Asked Questions

What is the IUPAC name of (3S)-3-acetamido-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-3-phenylpropanamide?
The IUPAC name of (3S)-3-acetamido-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-3-phenylpropanamide (CID 97027799) is (3S)-3-acetamido-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-3-phenylpropanamide.
What is the SMILES notation for (3S)-3-acetamido-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-3-phenylpropanamide?
The canonical SMILES for (3S)-3-acetamido-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-3-phenylpropanamide is CC(=O)N[C@@H](CC(=O)N[C@H]1CC(=O)N(c2ccccc2)C1)c1ccccc1.
What is the InChIKey of (3S)-3-acetamido-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-3-phenylpropanamide?
The InChIKey is XTWNGZCESBNMAG-HKUYNNGSSA-N. The full InChI is InChI=1S/C21H23N3O3/c1-15(25)22-19(16-8-4-2-5-9-16)13-20(26)23-17-12-21(27)24(14-17)18-10-6-3-7-11-18/h2-11,17,19H,12-14H2,1H3,(H,22,25)(H,23,26)/t17-,19-/m0/s1.
What are the key properties of (3S)-3-acetamido-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-3-phenylpropanamide?
(3S)-3-acetamido-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-3-phenylpropanamide has a molecular weight of 365.43 g/mol, XLogP of 2.18, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-acetamido-N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-3-phenylpropanamide is sourced from PubChem (CID 97027799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).