[2-phenyl-4-(trifluoromethyl)-1H-imidazol-5-yl]methanol

C11H9F3N2O — CID 66757293

IUPAC[2-phenyl-4-(trifluoromethyl)-1H-imidazol-5-yl]methanol
SMILESOCc1[nH]c(-c2ccccc2)nc1C(F)(F)F
InChIInChI=1S/C11H9F3N2O/c12-11(13,14)9-8(6-17)15-10(16-9)7-4-2-1-3-5-7/h1-5,17H,6H2,(H,15,16)
InChIKeyCOVVJPNWGAPQCD-UHFFFAOYSA-N
MW242.20 g/mol
LogP2.59
Rot. Bonds2

About [2-phenyl-4-(trifluoromethyl)-1H-imidazol-5-yl]methanol

[2-phenyl-4-(trifluoromethyl)-1H-imidazol-5-yl]methanol (PubChem CID 66757293) has the molecular formula C11H9F3N2O and a molecular weight of 242.20 g/mol. Its IUPAC name is [2-phenyl-4-(trifluoromethyl)-1H-imidazol-5-yl]methanol.

Molecular Properties

Compound Name[2-phenyl-4-(trifluoromethyl)-1H-imidazol-5-yl]methanol
PubChem CID66757293
Molecular FormulaC11H9F3N2O
Molecular Weight242.20 g/mol
Exact Mass242.07
IUPAC Name[2-phenyl-4-(trifluoromethyl)-1H-imidazol-5-yl]methanol
SMILESOCc1[nH]c(-c2ccccc2)nc1C(F)(F)F
InChIInChI=1S/C11H9F3N2O/c12-11(13,14)9-8(6-17)15-10(16-9)7-4-2-1-3-5-7/h1-5,17H,6H2,(H,15,16)
InChIKeyCOVVJPNWGAPQCD-UHFFFAOYSA-N
XLogP2.59
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.20
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze [2-phenyl-4-(trifluoromethyl)-1H-imidazol-5-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

Frequently Asked Questions

What is the IUPAC name of [2-phenyl-4-(trifluoromethyl)-1H-imidazol-5-yl]methanol?
The IUPAC name of [2-phenyl-4-(trifluoromethyl)-1H-imidazol-5-yl]methanol (CID 66757293) is [2-phenyl-4-(trifluoromethyl)-1H-imidazol-5-yl]methanol.
What is the SMILES notation for [2-phenyl-4-(trifluoromethyl)-1H-imidazol-5-yl]methanol?
The canonical SMILES for [2-phenyl-4-(trifluoromethyl)-1H-imidazol-5-yl]methanol is OCc1[nH]c(-c2ccccc2)nc1C(F)(F)F.
What is the InChIKey of [2-phenyl-4-(trifluoromethyl)-1H-imidazol-5-yl]methanol?
The InChIKey is COVVJPNWGAPQCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9F3N2O/c12-11(13,14)9-8(6-17)15-10(16-9)7-4-2-1-3-5-7/h1-5,17H,6H2,(H,15,16).
What are the key properties of [2-phenyl-4-(trifluoromethyl)-1H-imidazol-5-yl]methanol?
[2-phenyl-4-(trifluoromethyl)-1H-imidazol-5-yl]methanol has a molecular weight of 242.20 g/mol, XLogP of 2.59, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-phenyl-4-(trifluoromethyl)-1H-imidazol-5-yl]methanol is sourced from PubChem (CID 66757293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).