4-benzoyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide

C21H22N2O3 — CID 18157014

IUPAC4-benzoyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide
SMILESO=C(NCCC(=O)N1CCCC1)c1ccc(C(=O)c2ccccc2)cc1
InChIInChI=1S/C21H22N2O3/c24-19(23-14-4-5-15-23)12-13-22-21(26)18-10-8-17(9-11-18)20(25)16-6-2-1-3-7-16/h1-3,6-11H,4-5,12-15H2,(H,22,26)
InChIKeyPGWQYCCDLBUUOA-UHFFFAOYSA-N
MW350.42 g/mol
LogP2.66
Rot. Bonds6

About 4-benzoyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide

4-benzoyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide (PubChem CID 18157014) has the molecular formula C21H22N2O3 and a molecular weight of 350.42 g/mol. Its IUPAC name is 4-benzoyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide.

Molecular Properties

Compound Name4-benzoyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide
PubChem CID18157014
Molecular FormulaC21H22N2O3
Molecular Weight350.42 g/mol
Exact Mass350.16
IUPAC Name4-benzoyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide
SMILESO=C(NCCC(=O)N1CCCC1)c1ccc(C(=O)c2ccccc2)cc1
InChIInChI=1S/C21H22N2O3/c24-19(23-14-4-5-15-23)12-13-22-21(26)18-10-8-17(9-11-18)20(25)16-6-2-1-3-7-16/h1-3,6-11H,4-5,12-15H2,(H,22,26)
InChIKeyPGWQYCCDLBUUOA-UHFFFAOYSA-N
XLogP2.66
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.42
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-oxo-3-piperidin-1-ylpropyl)benzamide
CID 17154515
N-(3-oxo-3-pyrrolidin-1-ylpropyl)-4-sulfanylbenzamide
CID 107034732
4-fluoro-N-(3-oxo-3-piperidin-1-ylpropyl)benzamide
CID 47250876
4-methylsulfanyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide
CID 18157100
N-(3-oxo-3-pyrrolidin-1-ylpropyl)-4-pyrazol-1-ylbenzamide
CID 18157119
4-[methyl(phenyl)sulfamoyl]-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide
CID 46564955
4-nitro-N-(3-oxo-3-piperidin-1-ylpropyl)benzamide
CID 7964038
4-chloro-N-[3-oxo-3-[(3-oxo-3-piperidin-1-ylpropyl)amino]propyl]benzamide
CID 55802990
N-[4-(1,4-diazepan-1-yl)-4-oxobutyl]benzamide
CID 119418551
1-benzyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrazole-4-carboxamide
CID 18157170
N-[3-oxo-3-[4-(thiophene-2-carbonyl)piperazin-1-yl]propyl]benzamide
CID 18115079
N-[3-oxo-3-(4-piperidin-1-ylpiperidin-1-yl)propyl]-4-phenoxybenzamide
CID 126577362

Frequently Asked Questions

What is the IUPAC name of 4-benzoyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide?
The IUPAC name of 4-benzoyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide (CID 18157014) is 4-benzoyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide.
What is the SMILES notation for 4-benzoyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide?
The canonical SMILES for 4-benzoyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide is O=C(NCCC(=O)N1CCCC1)c1ccc(C(=O)c2ccccc2)cc1.
What is the InChIKey of 4-benzoyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide?
The InChIKey is PGWQYCCDLBUUOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N2O3/c24-19(23-14-4-5-15-23)12-13-22-21(26)18-10-8-17(9-11-18)20(25)16-6-2-1-3-7-16/h1-3,6-11H,4-5,12-15H2,(H,22,26).
What are the key properties of 4-benzoyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide?
4-benzoyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide has a molecular weight of 350.42 g/mol, XLogP of 2.66, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzoyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide is sourced from PubChem (CID 18157014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).