2-[(2R,3S)-1-benzyl-5-oxo-3-propan-2-ylpyrrolidin-2-yl]-N-cyclopropyl-2-oxoacetamide

C19H24N2O3 — CID 134349725

IUPAC2-[(2R,3S)-1-benzyl-5-oxo-3-propan-2-ylpyrrolidin-2-yl]-N-cyclopropyl-2-oxoacetamide
SMILESCC(C)[C@@H]1CC(=O)N(Cc2ccccc2)[C@H]1C(=O)C(=O)NC1CC1
InChIInChI=1S/C19H24N2O3/c1-12(2)15-10-16(22)21(11-13-6-4-3-5-7-13)17(15)18(23)19(24)20-14-8-9-14/h3-7,12,14-15,17H,8-11H2,1-2H3,(H,20,24)/t15-,17+/m0/s1
InChIKeyUJXFRPMHJNQEFT-DOTOQJQBSA-N
MW328.41 g/mol
LogP1.91
Rot. Bonds6

About 2-[(2R,3S)-1-benzyl-5-oxo-3-propan-2-ylpyrrolidin-2-yl]-N-cyclopropyl-2-oxoacetamide

2-[(2R,3S)-1-benzyl-5-oxo-3-propan-2-ylpyrrolidin-2-yl]-N-cyclopropyl-2-oxoacetamide (PubChem CID 134349725) has the molecular formula C19H24N2O3 and a molecular weight of 328.41 g/mol. Its IUPAC name is 2-[(2R,3S)-1-benzyl-5-oxo-3-propan-2-ylpyrrolidin-2-yl]-N-cyclopropyl-2-oxoacetamide.

Molecular Properties

Compound Name2-[(2R,3S)-1-benzyl-5-oxo-3-propan-2-ylpyrrolidin-2-yl]-N-cyclopropyl-2-oxoacetamide
PubChem CID134349725
Molecular FormulaC19H24N2O3
Molecular Weight328.41 g/mol
Exact Mass328.18
IUPAC Name2-[(2R,3S)-1-benzyl-5-oxo-3-propan-2-ylpyrrolidin-2-yl]-N-cyclopropyl-2-oxoacetamide
SMILESCC(C)[C@@H]1CC(=O)N(Cc2ccccc2)[C@H]1C(=O)C(=O)NC1CC1
InChIInChI=1S/C19H24N2O3/c1-12(2)15-10-16(22)21(11-13-6-4-3-5-7-13)17(15)18(23)19(24)20-14-8-9-14/h3-7,12,14-15,17H,8-11H2,1-2H3,(H,20,24)/t15-,17+/m0/s1
InChIKeyUJXFRPMHJNQEFT-DOTOQJQBSA-N
XLogP1.91
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-[(2R,3S)-1-benzyl-5-oxo-3-propan-2-ylpyrrolidin-2-yl]-N-cyclopropyl-2-oxoacetamide 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-benzyl-5-oxopyrrolidin-2-yl)-N-cyclopropyl-2-oxoacetamide
CID 139335074
2-[(2R)-1-benzyl-5-oxopyrrolidin-2-yl]-N-cyclobutyl-2-oxoacetamide
CID 134349466
1-benzyl-N-cyclopropyl-4-propan-2-ylpyrrolidine-3-carboxamide
CID 155963829
3-[[2-[(2R)-1-benzyl-5-oxopyrrolidin-2-yl]-2-oxoacetyl]amino]azetidine-1-carboxylic acid
CID 134349828
3-benzyl-2-oxo-5-propan-2-ylimidazolidine-4-carboxylic acid
CID 66523901
2-[(2R)-1-benzyl-5-oxopyrrolidin-2-yl]-N-methyl-2-oxoacetamide
CID 139335095
1-benzyl-N-[2-(cyclopropylamino)-2-oxoethyl]-5-oxopyrrolidine-2-carboxamide
CID 110625068
(4R)-1-benzyl-4-(hydroxymethyl)azetidin-2-one
CID 10856298
2-[(2R)-1-benzyl-5-oxopyrrolidin-2-yl]-N-[1-(cyclobutanecarbonyl)azetidin-3-yl]-2-oxoacetamide
CID 134349368
1-benzyl-5-oxo-2-phenylpyrrolidine-3-carboxylic acid
CID 4025878
2-[(2R)-1-benzyl-5-oxopyrrolidin-2-yl]-N-ethyl-2-oxoacetamide
CID 139335049
(2S)-2-amino-N-(1-benzylpiperidin-4-yl)propanamide
CID 770488

Frequently Asked Questions

What is the IUPAC name of 2-[(2R,3S)-1-benzyl-5-oxo-3-propan-2-ylpyrrolidin-2-yl]-N-cyclopropyl-2-oxoacetamide?
The IUPAC name of 2-[(2R,3S)-1-benzyl-5-oxo-3-propan-2-ylpyrrolidin-2-yl]-N-cyclopropyl-2-oxoacetamide (CID 134349725) is 2-[(2R,3S)-1-benzyl-5-oxo-3-propan-2-ylpyrrolidin-2-yl]-N-cyclopropyl-2-oxoacetamide.
What is the SMILES notation for 2-[(2R,3S)-1-benzyl-5-oxo-3-propan-2-ylpyrrolidin-2-yl]-N-cyclopropyl-2-oxoacetamide?
The canonical SMILES for 2-[(2R,3S)-1-benzyl-5-oxo-3-propan-2-ylpyrrolidin-2-yl]-N-cyclopropyl-2-oxoacetamide is CC(C)[C@@H]1CC(=O)N(Cc2ccccc2)[C@H]1C(=O)C(=O)NC1CC1.
What is the InChIKey of 2-[(2R,3S)-1-benzyl-5-oxo-3-propan-2-ylpyrrolidin-2-yl]-N-cyclopropyl-2-oxoacetamide?
The InChIKey is UJXFRPMHJNQEFT-DOTOQJQBSA-N. The full InChI is InChI=1S/C19H24N2O3/c1-12(2)15-10-16(22)21(11-13-6-4-3-5-7-13)17(15)18(23)19(24)20-14-8-9-14/h3-7,12,14-15,17H,8-11H2,1-2H3,(H,20,24)/t15-,17+/m0/s1.
What are the key properties of 2-[(2R,3S)-1-benzyl-5-oxo-3-propan-2-ylpyrrolidin-2-yl]-N-cyclopropyl-2-oxoacetamide?
2-[(2R,3S)-1-benzyl-5-oxo-3-propan-2-ylpyrrolidin-2-yl]-N-cyclopropyl-2-oxoacetamide has a molecular weight of 328.41 g/mol, XLogP of 1.91, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R,3S)-1-benzyl-5-oxo-3-propan-2-ylpyrrolidin-2-yl]-N-cyclopropyl-2-oxoacetamide is sourced from PubChem (CID 134349725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).