2-(2-chlorophenyl)-N-[2-(1-propylbenzimidazol-2-yl)ethyl]acetamide

C20H22ClN3O — CID 16979229

IUPAC2-(2-chlorophenyl)-N-[2-(1-propylbenzimidazol-2-yl)ethyl]acetamide
SMILESCCCn1c(CCNC(=O)Cc2ccccc2Cl)nc2ccccc21
InChIInChI=1S/C20H22ClN3O/c1-2-13-24-18-10-6-5-9-17(18)23-19(24)11-12-22-20(25)14-15-7-3-4-8-16(15)21/h3-10H,2,11-14H2,1H3,(H,22,25)
InChIKeyBBYSLJNHYVQZNX-UHFFFAOYSA-N
MW355.87 g/mol
LogP4.00
Rot. Bonds7

About 2-(2-chlorophenyl)-N-[2-(1-propylbenzimidazol-2-yl)ethyl]acetamide

2-(2-chlorophenyl)-N-[2-(1-propylbenzimidazol-2-yl)ethyl]acetamide (PubChem CID 16979229) has the molecular formula C20H22ClN3O and a molecular weight of 355.87 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-N-[2-(1-propylbenzimidazol-2-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(2-chlorophenyl)-N-[2-(1-propylbenzimidazol-2-yl)ethyl]acetamide
PubChem CID16979229
Molecular FormulaC20H22ClN3O
Molecular Weight355.87 g/mol
Exact Mass355.15
IUPAC Name2-(2-chlorophenyl)-N-[2-(1-propylbenzimidazol-2-yl)ethyl]acetamide
SMILESCCCn1c(CCNC(=O)Cc2ccccc2Cl)nc2ccccc21
InChIInChI=1S/C20H22ClN3O/c1-2-13-24-18-10-6-5-9-17(18)23-19(24)11-12-22-20(25)14-15-7-3-4-8-16(15)21/h3-10H,2,11-14H2,1H3,(H,22,25)
InChIKeyBBYSLJNHYVQZNX-UHFFFAOYSA-N
XLogP4.00
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.87
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-chlorophenyl)-N-[3-(1-dodecylbenzimidazol-2-yl)propyl]acetamide
CID 16985199
2-(2-chlorophenyl)-N-[5-(1-octylbenzimidazol-2-yl)pentyl]acetamide
CID 16993655
2-(2-chlorophenyl)-N-[2-[1-[(4-methylphenyl)methyl]benzimidazol-2-yl]ethyl]acetamide
CID 16979272
N-[2-[1-(2-bromoprop-2-enyl)benzimidazol-2-yl]ethyl]-2-(2-chlorophenyl)acetamide
CID 16979232
2-(2-chlorophenyl)-N-[2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]ethyl]acetamide
CID 16979371
2-(2-chlorophenyl)-N-[2-[1-[(3,4-dichlorophenyl)methyl]benzimidazol-2-yl]ethyl]acetamide
CID 16979261
2-(2-chlorophenyl)-N-[2-[1-[2-(2-propan-2-ylphenoxy)ethyl]benzimidazol-2-yl]ethyl]acetamide
CID 16979284
N-[2-(1-butylbenzimidazol-2-yl)ethyl]-2-(2-methylphenyl)acetamide
CID 16979073
N-[2-[1-[3-(4-chloro-3,5-dimethylphenoxy)propyl]benzimidazol-2-yl]ethyl]-2-(2-chlorophenyl)acetamide
CID 16979319
N-[2-(1-decylbenzimidazol-2-yl)ethyl]-2-(2-methylphenyl)acetamide
CID 16979081
3-[2-[(2-chlorophenyl)methyl]benzimidazol-1-yl]-N-propylpropanamide
CID 42810560
2-(4-chlorophenyl)-N-[2-(1-heptylbenzimidazol-2-yl)ethyl]acetamide
CID 16979402

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-N-[2-(1-propylbenzimidazol-2-yl)ethyl]acetamide?
The IUPAC name of 2-(2-chlorophenyl)-N-[2-(1-propylbenzimidazol-2-yl)ethyl]acetamide (CID 16979229) is 2-(2-chlorophenyl)-N-[2-(1-propylbenzimidazol-2-yl)ethyl]acetamide.
What is the SMILES notation for 2-(2-chlorophenyl)-N-[2-(1-propylbenzimidazol-2-yl)ethyl]acetamide?
The canonical SMILES for 2-(2-chlorophenyl)-N-[2-(1-propylbenzimidazol-2-yl)ethyl]acetamide is CCCn1c(CCNC(=O)Cc2ccccc2Cl)nc2ccccc21.
What is the InChIKey of 2-(2-chlorophenyl)-N-[2-(1-propylbenzimidazol-2-yl)ethyl]acetamide?
The InChIKey is BBYSLJNHYVQZNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22ClN3O/c1-2-13-24-18-10-6-5-9-17(18)23-19(24)11-12-22-20(25)14-15-7-3-4-8-16(15)21/h3-10H,2,11-14H2,1H3,(H,22,25).
What are the key properties of 2-(2-chlorophenyl)-N-[2-(1-propylbenzimidazol-2-yl)ethyl]acetamide?
2-(2-chlorophenyl)-N-[2-(1-propylbenzimidazol-2-yl)ethyl]acetamide has a molecular weight of 355.87 g/mol, XLogP of 4.00, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-N-[2-(1-propylbenzimidazol-2-yl)ethyl]acetamide is sourced from PubChem (CID 16979229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).