N-[[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]methyl]-3-phenylpropanamide

C24H22FN3O — CID 16970622

IUPACN-[[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]methyl]-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)NCc1nc2ccccc2n1Cc1ccc(F)cc1
InChIInChI=1S/C24H22FN3O/c25-20-13-10-19(11-14-20)17-28-22-9-5-4-8-21(22)27-23(28)16-26-24(29)15-12-18-6-2-1-3-7-18/h1-11,13-14H,12,15-17H2,(H,26,29)
InChIKeyOEXQAEHRPQCDKE-UHFFFAOYSA-N
MW387.46 g/mol
LogP4.47
Rot. Bonds7

About N-[[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]methyl]-3-phenylpropanamide

N-[[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]methyl]-3-phenylpropanamide (PubChem CID 16970622) has the molecular formula C24H22FN3O and a molecular weight of 387.46 g/mol. Its IUPAC name is N-[[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]methyl]-3-phenylpropanamide.

Molecular Properties

Compound NameN-[[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]methyl]-3-phenylpropanamide
PubChem CID16970622
Molecular FormulaC24H22FN3O
Molecular Weight387.46 g/mol
Exact Mass387.17
IUPAC NameN-[[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]methyl]-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)NCc1nc2ccccc2n1Cc1ccc(F)cc1
InChIInChI=1S/C24H22FN3O/c25-20-13-10-19(11-14-20)17-28-22-9-5-4-8-21(22)27-23(28)16-26-24(29)15-12-18-6-2-1-3-7-18/h1-11,13-14H,12,15-17H2,(H,26,29)
InChIKeyOEXQAEHRPQCDKE-UHFFFAOYSA-N
XLogP4.47
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.46
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]methyl]-3-phenylpropanamide 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-[[1-[(3-bromophenyl)methyl]benzimidazol-2-yl]methyl]-3-phenylpropanamide
CID 16970620
2-(4-chlorophenoxy)-N-[[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]methyl]acetamide
CID 16971102
N-[(1-pentylbenzimidazol-2-yl)methyl]-3-phenylpropanamide
CID 16970596
N-[[1-(3-methylbutyl)benzimidazol-2-yl]methyl]-3-phenylpropanamide
CID 16970595
2-ethyl-N-[[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]methyl]butanamide
CID 17006380
N-[(1-benzylbenzimidazol-2-yl)methyl]-2-phenoxyacetamide
CID 993353
N-[2-[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]ethyl]-2-methylpropanamide
CID 976977
2-benzyl-1-[(4-fluorophenyl)methyl]benzimidazole
CID 709541
4-fluoro-N-[[1-[(4-propan-2-ylphenyl)methyl]benzimidazol-2-yl]methyl]benzamide
CID 17008866
N-[[1-[2-(4-chlorophenoxy)ethyl]benzimidazol-2-yl]methyl]-3-phenylpropanamide
CID 16970652
4-fluoro-N-[[1-(3-phenylpropyl)benzimidazol-2-yl]methyl]benzamide
CID 17008873
N-[[1-(2-cyclohexylethyl)benzimidazol-2-yl]methyl]-3-phenylpropanamide
CID 16970632

Frequently Asked Questions

What is the IUPAC name of N-[[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]methyl]-3-phenylpropanamide?
The IUPAC name of N-[[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]methyl]-3-phenylpropanamide (CID 16970622) is N-[[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]methyl]-3-phenylpropanamide.
What is the SMILES notation for N-[[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]methyl]-3-phenylpropanamide?
The canonical SMILES for N-[[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]methyl]-3-phenylpropanamide is O=C(CCc1ccccc1)NCc1nc2ccccc2n1Cc1ccc(F)cc1.
What is the InChIKey of N-[[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]methyl]-3-phenylpropanamide?
The InChIKey is OEXQAEHRPQCDKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22FN3O/c25-20-13-10-19(11-14-20)17-28-22-9-5-4-8-21(22)27-23(28)16-26-24(29)15-12-18-6-2-1-3-7-18/h1-11,13-14H,12,15-17H2,(H,26,29).
What are the key properties of N-[[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]methyl]-3-phenylpropanamide?
N-[[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]methyl]-3-phenylpropanamide has a molecular weight of 387.46 g/mol, XLogP of 4.47, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]methyl]-3-phenylpropanamide is sourced from PubChem (CID 16970622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).