2-(2-chlorophenyl)-N-[2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]ethyl]acetamide

C23H25ClN4O2 — CID 16979371

About 2-(2-chlorophenyl)-N-[2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]ethyl]acetamide

2-(2-chlorophenyl)-N-[2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]ethyl]acetamide (PubChem CID 16979371) has the molecular formula C23H25ClN4O2 and a molecular weight of 424.93 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-N-[2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]ethyl]acetamide.

Molecular Properties

• Compound Name: 2-(2-chlorophenyl)-N-[2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]ethyl]acetamide
• PubChem CID: 16979371
• Molecular Formula: C23H25ClN4O2
• Molecular Weight: 424.93 g/mol
• Exact Mass: 424.17
• IUPAC Name: 2-(2-chlorophenyl)-N-[2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]ethyl]acetamide
• SMILES: O=C(Cc1ccccc1Cl)NCCc1nc2ccccc2n1CC(=O)N1CCCC1
• InChI: InChI=1S/C23H25ClN4O2/c24-18-8-2-1-7-17(18)15-22(29)25-12-11-21-26-19-9-3-4-10-20(19)28(21)16-23(30)27-13-5-6-14-27/h1-4,7-10H,5-6,11-16H2,(H,25,29)
• InChIKey: POMHOJSEJPESCU-UHFFFAOYSA-N
• XLogP: 3.21
• TPSA: 67.23 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 7
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	424.93
LogP ≤ 5	3.21
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-N-[2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]ethyl]acetamide?

The IUPAC name of 2-(2-chlorophenyl)-N-[2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]ethyl]acetamide (CID 16979371) is 2-(2-chlorophenyl)-N-[2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]ethyl]acetamide.

What is the SMILES notation for 2-(2-chlorophenyl)-N-[2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]ethyl]acetamide?

The canonical SMILES for 2-(2-chlorophenyl)-N-[2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]ethyl]acetamide is O=C(Cc1ccccc1Cl)NCCc1nc2ccccc2n1CC(=O)N1CCCC1.

What is the InChIKey of 2-(2-chlorophenyl)-N-[2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]ethyl]acetamide?

The InChIKey is POMHOJSEJPESCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25ClN4O2/c24-18-8-2-1-7-17(18)15-22(29)25-12-11-21-26-19-9-3-4-10-20(19)28(21)16-23(30)27-13-5-6-14-27/h1-4,7-10H,5-6,11-16H2,(H,25,29).

What are the key properties of 2-(2-chlorophenyl)-N-[2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]ethyl]acetamide?

2-(2-chlorophenyl)-N-[2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]ethyl]acetamide has a molecular weight of 424.93 g/mol, XLogP of 3.21, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(2-chlorophenyl)-N-[2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]ethyl]acetamide is sourced from PubChem (CID 16979371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).