5-(4-fluorophenyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]pentanamide

C20H22FN3O2 — CID 110617564

IUPAC5-(4-fluorophenyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]pentanamide
SMILESO=C(CCCCc1ccc(F)cc1)NCCn1c(=O)[nH]c2ccccc21
InChIInChI=1S/C20H22FN3O2/c21-16-11-9-15(10-12-16)5-1-4-8-19(25)22-13-14-24-18-7-3-2-6-17(18)23-20(24)26/h2-3,6-7,9-12H,1,4-5,8,13-14H2,(H,22,25)(H,23,26)
InChIKeyIUFLLCDWWBZNHJ-UHFFFAOYSA-N
MW355.41 g/mol
LogP3.00
Rot. Bonds8

About 5-(4-fluorophenyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]pentanamide

5-(4-fluorophenyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]pentanamide (PubChem CID 110617564) has the molecular formula C20H22FN3O2 and a molecular weight of 355.41 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]pentanamide.

Molecular Properties

Compound Name5-(4-fluorophenyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]pentanamide
PubChem CID110617564
Molecular FormulaC20H22FN3O2
Molecular Weight355.41 g/mol
Exact Mass355.17
IUPAC Name5-(4-fluorophenyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]pentanamide
SMILESO=C(CCCCc1ccc(F)cc1)NCCn1c(=O)[nH]c2ccccc21
InChIInChI=1S/C20H22FN3O2/c21-16-11-9-15(10-12-16)5-1-4-8-19(25)22-13-14-24-18-7-3-2-6-17(18)23-20(24)26/h2-3,6-7,9-12H,1,4-5,8,13-14H2,(H,22,25)(H,23,26)
InChIKeyIUFLLCDWWBZNHJ-UHFFFAOYSA-N
XLogP3.00
TPSA66.89 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.41
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 5-(4-fluorophenyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]pentanamide 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

3-(4-fluorophenyl)-N-[3-(2-oxo-3H-benzimidazol-1-yl)propyl]propanamide
CID 110610959
2-(4-fluorophenyl)-N-[3-(2-oxo-3H-benzimidazol-1-yl)propyl]acetamide
CID 110419711
4-(3-chlorophenyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]butanamide
CID 110420297
N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]-2-phenylacetamide
CID 110400739
N-[2-(2,3-dioxo-4H-quinoxalin-1-yl)ethyl]-2-(4-fluorophenyl)acetamide
CID 110396431
N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]-3-thiophen-2-ylpropanamide
CID 110400789
4-(2-methylphenyl)-N-[3-(2-oxo-3H-benzimidazol-1-yl)propyl]butanamide
CID 110420411
N-[2-(4-fluorophenyl)ethyl]-4-phenylbutanamide
CID 2288121
2-(2-methoxyphenoxy)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]acetamide
CID 110400765
3-(2-methoxyphenyl)-N-[3-(2-oxo-3H-benzimidazol-1-yl)propyl]propanamide
CID 110419764
3-(4-fluorophenyl)-4-methyl-N-[3-(2-oxo-3H-benzimidazol-1-yl)propyl]pentanamide
CID 110420339
6-(2-oxo-3H-benzimidazol-1-yl)hexylcarbamic acid
CID 21273383

Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]pentanamide?
The IUPAC name of 5-(4-fluorophenyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]pentanamide (CID 110617564) is 5-(4-fluorophenyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]pentanamide.
What is the SMILES notation for 5-(4-fluorophenyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]pentanamide?
The canonical SMILES for 5-(4-fluorophenyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]pentanamide is O=C(CCCCc1ccc(F)cc1)NCCn1c(=O)[nH]c2ccccc21.
What is the InChIKey of 5-(4-fluorophenyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]pentanamide?
The InChIKey is IUFLLCDWWBZNHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22FN3O2/c21-16-11-9-15(10-12-16)5-1-4-8-19(25)22-13-14-24-18-7-3-2-6-17(18)23-20(24)26/h2-3,6-7,9-12H,1,4-5,8,13-14H2,(H,22,25)(H,23,26).
What are the key properties of 5-(4-fluorophenyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]pentanamide?
5-(4-fluorophenyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]pentanamide has a molecular weight of 355.41 g/mol, XLogP of 3.00, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-N-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]pentanamide is sourced from PubChem (CID 110617564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).