2-(2-methylphenyl)-N-[5-[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]pentyl]acetamide

C34H37N3O2 — CID 16993582

IUPAC2-(2-methylphenyl)-N-[5-[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]pentyl]acetamide
SMILESCc1ccccc1CC(=O)NCCCCCc1nc2ccccc2n1CCCOc1ccc2ccccc2c1
InChIInChI=1S/C34H37N3O2/c1-26-12-4-5-14-28(26)25-34(38)35-21-10-2-3-18-33-36-31-16-8-9-17-32(31)37(33)22-11-23-39-30-20-19-27-13-6-7-15-29(27)24-30/h4-9,12-17,19-20,24H,2-3,10-11,18,21-23,25H2,1H3,(H,35,38)
InChIKeyZHUZKFICUWQWKE-UHFFFAOYSA-N
MW519.69 g/mol
LogP7.04
Rot. Bonds13

About 2-(2-methylphenyl)-N-[5-[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]pentyl]acetamide

2-(2-methylphenyl)-N-[5-[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]pentyl]acetamide (PubChem CID 16993582) has the molecular formula C34H37N3O2 and a molecular weight of 519.69 g/mol. Its IUPAC name is 2-(2-methylphenyl)-N-[5-[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]pentyl]acetamide.

Molecular Properties

Compound Name2-(2-methylphenyl)-N-[5-[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]pentyl]acetamide
PubChem CID16993582
Molecular FormulaC34H37N3O2
Molecular Weight519.69 g/mol
Exact Mass519.29
IUPAC Name2-(2-methylphenyl)-N-[5-[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]pentyl]acetamide
SMILESCc1ccccc1CC(=O)NCCCCCc1nc2ccccc2n1CCCOc1ccc2ccccc2c1
InChIInChI=1S/C34H37N3O2/c1-26-12-4-5-14-28(26)25-34(38)35-21-10-2-3-18-33-36-31-16-8-9-17-32(31)37(33)22-11-23-39-30-20-19-27-13-6-7-15-29(27)24-30/h4-9,12-17,19-20,24H,2-3,10-11,18,21-23,25H2,1H3,(H,35,38)
InChIKeyZHUZKFICUWQWKE-UHFFFAOYSA-N
XLogP7.04
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500519.69
LogP ≤ 57.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-(2-methylphenyl)-N-[5-[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]pentyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[5-[1-[3-(4-methylphenoxy)propyl]benzimidazol-2-yl]pentyl]-2-(2-methylphenyl)acetamide
CID 16993574
N-[5-[1-[4-(4-chloro-3-methylphenoxy)butyl]benzimidazol-2-yl]pentyl]-2-(2-methylphenyl)acetamide
CID 16993601
N-[3-[1-[2-(3,4-dimethylphenoxy)ethyl]benzimidazol-2-yl]propyl]-2-(2-methylphenyl)acetamide
CID 16985123
N-[2-[1-[3-(3,5-dimethylphenoxy)propyl]benzimidazol-2-yl]ethyl]-2-(2-methylphenyl)acetamide
CID 16979156
N-[5-[1-[3-(2-chlorophenoxy)propyl]benzimidazol-2-yl]pentyl]-2-(2-methylphenyl)acetamide
CID 16993567
2-(2-methylphenyl)-N-[5-(1-pentylbenzimidazol-2-yl)pentyl]acetamide
CID 16993490
N-[5-[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]pentyl]-3-phenylpropanamide
CID 16992610
N-[5-[1-[4-(3,4-dimethylphenoxy)butyl]benzimidazol-2-yl]pentyl]-2-phenylacetamide
CID 16993436
N-[5-[1-[3-(3,4-dimethylphenoxy)propyl]benzimidazol-2-yl]pentyl]propanamide
CID 16988067
N-[5-[1-[4-(2,4-dimethylphenoxy)butyl]benzimidazol-2-yl]pentyl]-2-(2-methylphenyl)acetamide
CID 16993587
N-[2-[1-[3-(4-chlorophenoxy)propyl]benzimidazol-2-yl]ethyl]-2-(2-methylphenyl)acetamide
CID 16979159
N-[5-[1-[3-(3,4-dimethylphenoxy)propyl]benzimidazol-2-yl]pentyl]-2-(4-phenylphenyl)acetamide
CID 16994385

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylphenyl)-N-[5-[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]pentyl]acetamide?
The IUPAC name of 2-(2-methylphenyl)-N-[5-[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]pentyl]acetamide (CID 16993582) is 2-(2-methylphenyl)-N-[5-[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]pentyl]acetamide.
What is the SMILES notation for 2-(2-methylphenyl)-N-[5-[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]pentyl]acetamide?
The canonical SMILES for 2-(2-methylphenyl)-N-[5-[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]pentyl]acetamide is Cc1ccccc1CC(=O)NCCCCCc1nc2ccccc2n1CCCOc1ccc2ccccc2c1.
What is the InChIKey of 2-(2-methylphenyl)-N-[5-[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]pentyl]acetamide?
The InChIKey is ZHUZKFICUWQWKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H37N3O2/c1-26-12-4-5-14-28(26)25-34(38)35-21-10-2-3-18-33-36-31-16-8-9-17-32(31)37(33)22-11-23-39-30-20-19-27-13-6-7-15-29(27)24-30/h4-9,12-17,19-20,24H,2-3,10-11,18,21-23,25H2,1H3,(H,35,38).
What are the key properties of 2-(2-methylphenyl)-N-[5-[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]pentyl]acetamide?
2-(2-methylphenyl)-N-[5-[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]pentyl]acetamide has a molecular weight of 519.69 g/mol, XLogP of 7.04, 13 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylphenyl)-N-[5-[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]pentyl]acetamide is sourced from PubChem (CID 16993582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).