3-(benzimidazol-1-yl)-N-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)propanamide

C22H24N4O2 — CID 126767257

IUPAC3-(benzimidazol-1-yl)-N-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)propanamide
SMILESCCN(C(=O)CCn1cnc2ccccc21)C1CCN(c2ccccc2)C1=O
InChIInChI=1S/C22H24N4O2/c1-2-25(20-12-15-26(22(20)28)17-8-4-3-5-9-17)21(27)13-14-24-16-23-18-10-6-7-11-19(18)24/h3-11,16,20H,2,12-15H2,1H3
InChIKeyCCSLJWKJSOQHDC-UHFFFAOYSA-N
MW376.46 g/mol
LogP3.08
Rot. Bonds6

About 3-(benzimidazol-1-yl)-N-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)propanamide

3-(benzimidazol-1-yl)-N-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)propanamide (PubChem CID 126767257) has the molecular formula C22H24N4O2 and a molecular weight of 376.46 g/mol. Its IUPAC name is 3-(benzimidazol-1-yl)-N-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)propanamide.

Molecular Properties

Compound Name3-(benzimidazol-1-yl)-N-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)propanamide
PubChem CID126767257
Molecular FormulaC22H24N4O2
Molecular Weight376.46 g/mol
Exact Mass376.19
IUPAC Name3-(benzimidazol-1-yl)-N-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)propanamide
SMILESCCN(C(=O)CCn1cnc2ccccc21)C1CCN(c2ccccc2)C1=O
InChIInChI=1S/C22H24N4O2/c1-2-25(20-12-15-26(22(20)28)17-8-4-3-5-9-17)21(27)13-14-24-16-23-18-10-6-7-11-19(18)24/h3-11,16,20H,2,12-15H2,1H3
InChIKeyCCSLJWKJSOQHDC-UHFFFAOYSA-N
XLogP3.08
TPSA58.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

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N-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide
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2-(aminomethyl)-N-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)-1,3-thiazole-4-carboxamide
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3-(benzimidazol-1-yl)-1-(3-hydroxypyrrolidin-1-yl)propan-1-one
CID 62918787
N-methyl-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]quinoxaline-2-carboxamide
CID 95618514
1-[(3R)-3-aminopyrrolidin-1-yl]-3-(benzimidazol-1-yl)propan-1-one
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2-(benzimidazol-1-yl)-N,N-dicyclohexylacetamide
CID 856407
3-(benzimidazol-1-yl)-N-[(4-fluorophenyl)methyl]-N-methylpropanamide
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7-amino-N-methyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)heptanamide
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Frequently Asked Questions

What is the IUPAC name of 3-(benzimidazol-1-yl)-N-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)propanamide?
The IUPAC name of 3-(benzimidazol-1-yl)-N-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)propanamide (CID 126767257) is 3-(benzimidazol-1-yl)-N-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)propanamide.
What is the SMILES notation for 3-(benzimidazol-1-yl)-N-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)propanamide?
The canonical SMILES for 3-(benzimidazol-1-yl)-N-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)propanamide is CCN(C(=O)CCn1cnc2ccccc21)C1CCN(c2ccccc2)C1=O.
What is the InChIKey of 3-(benzimidazol-1-yl)-N-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)propanamide?
The InChIKey is CCSLJWKJSOQHDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O2/c1-2-25(20-12-15-26(22(20)28)17-8-4-3-5-9-17)21(27)13-14-24-16-23-18-10-6-7-11-19(18)24/h3-11,16,20H,2,12-15H2,1H3.
What are the key properties of 3-(benzimidazol-1-yl)-N-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)propanamide?
3-(benzimidazol-1-yl)-N-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)propanamide has a molecular weight of 376.46 g/mol, XLogP of 3.08, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(benzimidazol-1-yl)-N-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)propanamide is sourced from PubChem (CID 126767257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).