2-(2-chlorophenyl)-N-[5-(1-methylbenzimidazol-2-yl)pentyl]acetamide

C21H24ClN3O — CID 16993642

IUPAC2-(2-chlorophenyl)-N-[5-(1-methylbenzimidazol-2-yl)pentyl]acetamide
SMILESCn1c(CCCCCNC(=O)Cc2ccccc2Cl)nc2ccccc21
InChIInChI=1S/C21H24ClN3O/c1-25-19-12-7-6-11-18(19)24-20(25)13-3-2-8-14-23-21(26)15-16-9-4-5-10-17(16)22/h4-7,9-12H,2-3,8,13-15H2,1H3,(H,23,26)
InChIKeyRFSNVXUVRCMXJJ-UHFFFAOYSA-N
MW369.90 g/mol
LogP4.30
Rot. Bonds8

About 2-(2-chlorophenyl)-N-[5-(1-methylbenzimidazol-2-yl)pentyl]acetamide

2-(2-chlorophenyl)-N-[5-(1-methylbenzimidazol-2-yl)pentyl]acetamide (PubChem CID 16993642) has the molecular formula C21H24ClN3O and a molecular weight of 369.90 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-N-[5-(1-methylbenzimidazol-2-yl)pentyl]acetamide.

Molecular Properties

Compound Name2-(2-chlorophenyl)-N-[5-(1-methylbenzimidazol-2-yl)pentyl]acetamide
PubChem CID16993642
Molecular FormulaC21H24ClN3O
Molecular Weight369.90 g/mol
Exact Mass369.16
IUPAC Name2-(2-chlorophenyl)-N-[5-(1-methylbenzimidazol-2-yl)pentyl]acetamide
SMILESCn1c(CCCCCNC(=O)Cc2ccccc2Cl)nc2ccccc21
InChIInChI=1S/C21H24ClN3O/c1-25-19-12-7-6-11-18(19)24-20(25)13-3-2-8-14-23-21(26)15-16-9-4-5-10-17(16)22/h4-7,9-12H,2-3,8,13-15H2,1H3,(H,23,26)
InChIKeyRFSNVXUVRCMXJJ-UHFFFAOYSA-N
XLogP4.30
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.90
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(4-chlorophenyl)-N-[5-(1-methylbenzimidazol-2-yl)pentyl]acetamide
CID 16993804
2-(2-chlorophenyl)-N-[5-(1-octylbenzimidazol-2-yl)pentyl]acetamide
CID 16993655
2-(2-chlorophenyl)-N-[5-[1-(2-methylpropyl)benzimidazol-2-yl]pentyl]acetamide
CID 16993644
2-(2-chlorophenyl)-N-[3-(1-dodecylbenzimidazol-2-yl)propyl]acetamide
CID 16985199
2-(2-chlorophenyl)-N-[5-[1-[(3,4-dichlorophenyl)methyl]benzimidazol-2-yl]pentyl]acetamide
CID 16993675
2-(2-chlorophenyl)-N-[5-[1-[2-(2-methoxyphenoxy)ethyl]benzimidazol-2-yl]pentyl]acetamide
CID 16993701
2-(2-chlorophenyl)-N-[5-[1-[2-(2-methylphenoxy)ethyl]benzimidazol-2-yl]pentyl]acetamide
CID 16993692
2-(2-chlorophenyl)-N-[5-[1-(2-oxo-2-piperidin-1-ylethyl)benzimidazol-2-yl]pentyl]acetamide
CID 16993786
2-(2-chlorophenyl)-N-[5-[1-[2-(dipropylamino)-2-oxoethyl]benzimidazol-2-yl]pentyl]acetamide
CID 16993774
2-(2-chlorophenyl)-N-[5-[1-[4-(4-ethylphenoxy)butyl]benzimidazol-2-yl]pentyl]acetamide
CID 16993766
2-(2-chlorophenyl)-N-[2-(1-propylbenzimidazol-2-yl)ethyl]acetamide
CID 16979229
2-(2-chlorophenyl)-N-[5-[1-[4-(2,4-dimethylphenoxy)butyl]benzimidazol-2-yl]pentyl]acetamide
CID 16993749

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-N-[5-(1-methylbenzimidazol-2-yl)pentyl]acetamide?
The IUPAC name of 2-(2-chlorophenyl)-N-[5-(1-methylbenzimidazol-2-yl)pentyl]acetamide (CID 16993642) is 2-(2-chlorophenyl)-N-[5-(1-methylbenzimidazol-2-yl)pentyl]acetamide.
What is the SMILES notation for 2-(2-chlorophenyl)-N-[5-(1-methylbenzimidazol-2-yl)pentyl]acetamide?
The canonical SMILES for 2-(2-chlorophenyl)-N-[5-(1-methylbenzimidazol-2-yl)pentyl]acetamide is Cn1c(CCCCCNC(=O)Cc2ccccc2Cl)nc2ccccc21.
What is the InChIKey of 2-(2-chlorophenyl)-N-[5-(1-methylbenzimidazol-2-yl)pentyl]acetamide?
The InChIKey is RFSNVXUVRCMXJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24ClN3O/c1-25-19-12-7-6-11-18(19)24-20(25)13-3-2-8-14-23-21(26)15-16-9-4-5-10-17(16)22/h4-7,9-12H,2-3,8,13-15H2,1H3,(H,23,26).
What are the key properties of 2-(2-chlorophenyl)-N-[5-(1-methylbenzimidazol-2-yl)pentyl]acetamide?
2-(2-chlorophenyl)-N-[5-(1-methylbenzimidazol-2-yl)pentyl]acetamide has a molecular weight of 369.90 g/mol, XLogP of 4.30, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-N-[5-(1-methylbenzimidazol-2-yl)pentyl]acetamide is sourced from PubChem (CID 16993642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).