N-cyclopropyl-2-(4-ethenyl-2-oxopyrrolidin-1-yl)benzamide

C16H18N2O2 — CID 168686066

IUPACN-cyclopropyl-2-(4-ethenyl-2-oxopyrrolidin-1-yl)benzamide
SMILESC=CC1CC(=O)N(c2ccccc2C(=O)NC2CC2)C1
InChIInChI=1S/C16H18N2O2/c1-2-11-9-15(19)18(10-11)14-6-4-3-5-13(14)16(20)17-12-7-8-12/h2-6,11-12H,1,7-10H2,(H,17,20)
InChIKeyOAIJDJJHONDPEX-UHFFFAOYSA-N
MW270.33 g/mol
LogP2.12
Rot. Bonds4

About N-cyclopropyl-2-(4-ethenyl-2-oxopyrrolidin-1-yl)benzamide

N-cyclopropyl-2-(4-ethenyl-2-oxopyrrolidin-1-yl)benzamide (PubChem CID 168686066) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is N-cyclopropyl-2-(4-ethenyl-2-oxopyrrolidin-1-yl)benzamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(4-ethenyl-2-oxopyrrolidin-1-yl)benzamide
PubChem CID168686066
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC NameN-cyclopropyl-2-(4-ethenyl-2-oxopyrrolidin-1-yl)benzamide
SMILESC=CC1CC(=O)N(c2ccccc2C(=O)NC2CC2)C1
InChIInChI=1S/C16H18N2O2/c1-2-11-9-15(19)18(10-11)14-6-4-3-5-13(14)16(20)17-12-7-8-12/h2-6,11-12H,1,7-10H2,(H,17,20)
InChIKeyOAIJDJJHONDPEX-UHFFFAOYSA-N
XLogP2.12
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-cyclopropyl-2-(4-ethenyl-2-oxopyrrolidin-1-yl)benzamide 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-cyclopropyl-2-[4-(prop-2-enylcarbamoylamino)piperidin-1-yl]benzamide
CID 46038566
1-[2-(aminomethyl)phenyl]-4-ethenylpyrrolidin-2-one
CID 168685419
(3S)-N-[2-(cyclopropylcarbamoyl)phenyl]-1-(2-fluorophenyl)-5-oxopyrrolidine-3-carboxamide
CID 30844050
2-(4-ethenyl-2-oxopyrrolidin-1-yl)-6-methylbenzoic acid
CID 168685006
methyl 2-[4-(cyclopropylcarbamoyl)-2-oxopyrrolidin-1-yl]benzoate
CID 113189115
2-(4-ethenyl-2-oxopyrrolidin-1-yl)-N,3-dimethylbenzamide
CID 168684989
2-(4-aminopiperidin-1-yl)-N-cyclopropylbenzamide
CID 42656462
N-cyclopropyl-2-[4-(2-methylpropanoylamino)piperidin-1-yl]benzamide
CID 42848047
2-[4-(hydroxymethyl)-2-oxopyrrolidin-1-yl]benzohydrazide
CID 168663727
methyl 3-(4-ethenyl-2-oxopyrrolidin-1-yl)-2,6-difluorobenzoate
CID 168684318
2-[4-(hydroxymethyl)-2-oxopyrrolidin-1-yl]-N-methylbenzamide
CID 168662246
N-cyclohexyl-2-pyrrolidin-1-ylbenzamide
CID 168514596

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(4-ethenyl-2-oxopyrrolidin-1-yl)benzamide?
The IUPAC name of N-cyclopropyl-2-(4-ethenyl-2-oxopyrrolidin-1-yl)benzamide (CID 168686066) is N-cyclopropyl-2-(4-ethenyl-2-oxopyrrolidin-1-yl)benzamide.
What is the SMILES notation for N-cyclopropyl-2-(4-ethenyl-2-oxopyrrolidin-1-yl)benzamide?
The canonical SMILES for N-cyclopropyl-2-(4-ethenyl-2-oxopyrrolidin-1-yl)benzamide is C=CC1CC(=O)N(c2ccccc2C(=O)NC2CC2)C1.
What is the InChIKey of N-cyclopropyl-2-(4-ethenyl-2-oxopyrrolidin-1-yl)benzamide?
The InChIKey is OAIJDJJHONDPEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-2-11-9-15(19)18(10-11)14-6-4-3-5-13(14)16(20)17-12-7-8-12/h2-6,11-12H,1,7-10H2,(H,17,20).
What are the key properties of N-cyclopropyl-2-(4-ethenyl-2-oxopyrrolidin-1-yl)benzamide?
N-cyclopropyl-2-(4-ethenyl-2-oxopyrrolidin-1-yl)benzamide has a molecular weight of 270.33 g/mol, XLogP of 2.12, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(4-ethenyl-2-oxopyrrolidin-1-yl)benzamide is sourced from PubChem (CID 168686066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).