[1-[[2-methyl-5-(trifluoromethyl)phenyl]methyl]benzimidazol-2-yl]methanol

C17H15F3N2O — CID 90026749

IUPAC[1-[[2-methyl-5-(trifluoromethyl)phenyl]methyl]benzimidazol-2-yl]methanol
SMILESCc1ccc(C(F)(F)F)cc1Cn1c(CO)nc2ccccc21
InChIInChI=1S/C17H15F3N2O/c1-11-6-7-13(17(18,19)20)8-12(11)9-22-15-5-3-2-4-14(15)21-16(22)10-23/h2-8,23H,9-10H2,1H3
InChIKeySDYVXKOAAAYKQG-UHFFFAOYSA-N
MW320.31 g/mol
LogP3.90
Rot. Bonds3

About [1-[[2-methyl-5-(trifluoromethyl)phenyl]methyl]benzimidazol-2-yl]methanol

[1-[[2-methyl-5-(trifluoromethyl)phenyl]methyl]benzimidazol-2-yl]methanol (PubChem CID 90026749) has the molecular formula C17H15F3N2O and a molecular weight of 320.31 g/mol. Its IUPAC name is [1-[[2-methyl-5-(trifluoromethyl)phenyl]methyl]benzimidazol-2-yl]methanol.

Molecular Properties

Compound Name[1-[[2-methyl-5-(trifluoromethyl)phenyl]methyl]benzimidazol-2-yl]methanol
PubChem CID90026749
Molecular FormulaC17H15F3N2O
Molecular Weight320.31 g/mol
Exact Mass320.11
IUPAC Name[1-[[2-methyl-5-(trifluoromethyl)phenyl]methyl]benzimidazol-2-yl]methanol
SMILESCc1ccc(C(F)(F)F)cc1Cn1c(CO)nc2ccccc21
InChIInChI=1S/C17H15F3N2O/c1-11-6-7-13(17(18,19)20)8-12(11)9-22-15-5-3-2-4-14(15)21-16(22)10-23/h2-8,23H,9-10H2,1H3
InChIKeySDYVXKOAAAYKQG-UHFFFAOYSA-N
XLogP3.90
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.31
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [1-[[2-methyl-5-(trifluoromethyl)phenyl]methyl]benzimidazol-2-yl]methanol 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

1-[(2,5-dimethylphenyl)methyl]-2-ethylbenzimidazole
CID 962442
2-[1-[(2-methylphenyl)methyl]benzimidazol-2-yl]ethanol
CID 17027842
[5-methyl-1-[(2-methylphenyl)methyl]benzimidazol-2-yl]methanol
CID 82333264
[1-[(2-fluorophenyl)methyl]-5-methylbenzimidazol-2-yl]methanol
CID 82333263
2-[(2-chlorophenyl)methyl]-1-[(2,5-dimethylphenyl)methyl]benzimidazole
CID 16995673
N-[5-[1-[(2,5-dimethylphenyl)methyl]benzimidazol-2-yl]pentyl]-2,2-dimethylpropanamide
CID 16988805
[1-[(2,5-dimethylphenyl)methyl]-6-pyridin-4-ylbenzimidazol-2-yl]methanol
CID 72700063
[1-[2-(diethylamino)ethyl]-5-(trifluoromethyl)benzimidazol-2-yl]methanol
CID 46309336
[1-(methoxymethyl)benzimidazol-2-yl]methanol
CID 1233949
N-[[1-[(2,5-dimethylphenyl)methyl]benzimidazol-2-yl]methyl]prop-2-enamide
CID 16972214
N-[3-[1-[(2,5-dimethylphenyl)methyl]benzimidazol-2-yl]propyl]-2-(2-methylphenyl)acetamide
CID 16985043
1-(4-fluoro-2-methylphenyl)-2-[2-(hydroxymethyl)benzimidazol-1-yl]ethanol
CID 111629898

Frequently Asked Questions

What is the IUPAC name of [1-[[2-methyl-5-(trifluoromethyl)phenyl]methyl]benzimidazol-2-yl]methanol?
The IUPAC name of [1-[[2-methyl-5-(trifluoromethyl)phenyl]methyl]benzimidazol-2-yl]methanol (CID 90026749) is [1-[[2-methyl-5-(trifluoromethyl)phenyl]methyl]benzimidazol-2-yl]methanol.
What is the SMILES notation for [1-[[2-methyl-5-(trifluoromethyl)phenyl]methyl]benzimidazol-2-yl]methanol?
The canonical SMILES for [1-[[2-methyl-5-(trifluoromethyl)phenyl]methyl]benzimidazol-2-yl]methanol is Cc1ccc(C(F)(F)F)cc1Cn1c(CO)nc2ccccc21.
What is the InChIKey of [1-[[2-methyl-5-(trifluoromethyl)phenyl]methyl]benzimidazol-2-yl]methanol?
The InChIKey is SDYVXKOAAAYKQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15F3N2O/c1-11-6-7-13(17(18,19)20)8-12(11)9-22-15-5-3-2-4-14(15)21-16(22)10-23/h2-8,23H,9-10H2,1H3.
What are the key properties of [1-[[2-methyl-5-(trifluoromethyl)phenyl]methyl]benzimidazol-2-yl]methanol?
[1-[[2-methyl-5-(trifluoromethyl)phenyl]methyl]benzimidazol-2-yl]methanol has a molecular weight of 320.31 g/mol, XLogP of 3.90, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[2-methyl-5-(trifluoromethyl)phenyl]methyl]benzimidazol-2-yl]methanol is sourced from PubChem (CID 90026749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).