2,3-diphenyl-5-(trifluoromethyl)-4H-imidazol-5-ol

C16H13F3N2O — CID 10859735

IUPAC2,3-diphenyl-5-(trifluoromethyl)-4H-imidazol-5-ol
SMILESOC1(C(F)(F)F)CN(c2ccccc2)C(c2ccccc2)=N1
InChIInChI=1S/C16H13F3N2O/c17-16(18,19)15(22)11-21(13-9-5-2-6-10-13)14(20-15)12-7-3-1-4-8-12/h1-10,22H,11H2
InChIKeyXOFUYGULGWMDFJ-UHFFFAOYSA-N
MW306.29 g/mol
LogP3.20
Rot. Bonds2

About 2,3-diphenyl-5-(trifluoromethyl)-4H-imidazol-5-ol

2,3-diphenyl-5-(trifluoromethyl)-4H-imidazol-5-ol (PubChem CID 10859735) has the molecular formula C16H13F3N2O and a molecular weight of 306.29 g/mol. Its IUPAC name is 2,3-diphenyl-5-(trifluoromethyl)-4H-imidazol-5-ol.

Molecular Properties

Compound Name2,3-diphenyl-5-(trifluoromethyl)-4H-imidazol-5-ol
PubChem CID10859735
Molecular FormulaC16H13F3N2O
Molecular Weight306.29 g/mol
Exact Mass306.10
IUPAC Name2,3-diphenyl-5-(trifluoromethyl)-4H-imidazol-5-ol
SMILESOC1(C(F)(F)F)CN(c2ccccc2)C(c2ccccc2)=N1
InChIInChI=1S/C16H13F3N2O/c17-16(18,19)15(22)11-21(13-9-5-2-6-10-13)14(20-15)12-7-3-1-4-8-12/h1-10,22H,11H2
InChIKeyXOFUYGULGWMDFJ-UHFFFAOYSA-N
XLogP3.20
TPSA35.83 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.29
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,3-diphenyl-5-(trifluoromethyl)-4H-imidazol-5-ol?
The IUPAC name of 2,3-diphenyl-5-(trifluoromethyl)-4H-imidazol-5-ol (CID 10859735) is 2,3-diphenyl-5-(trifluoromethyl)-4H-imidazol-5-ol.
What is the SMILES notation for 2,3-diphenyl-5-(trifluoromethyl)-4H-imidazol-5-ol?
The canonical SMILES for 2,3-diphenyl-5-(trifluoromethyl)-4H-imidazol-5-ol is OC1(C(F)(F)F)CN(c2ccccc2)C(c2ccccc2)=N1.
What is the InChIKey of 2,3-diphenyl-5-(trifluoromethyl)-4H-imidazol-5-ol?
The InChIKey is XOFUYGULGWMDFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13F3N2O/c17-16(18,19)15(22)11-21(13-9-5-2-6-10-13)14(20-15)12-7-3-1-4-8-12/h1-10,22H,11H2.
What are the key properties of 2,3-diphenyl-5-(trifluoromethyl)-4H-imidazol-5-ol?
2,3-diphenyl-5-(trifluoromethyl)-4H-imidazol-5-ol has a molecular weight of 306.29 g/mol, XLogP of 3.20, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-diphenyl-5-(trifluoromethyl)-4H-imidazol-5-ol is sourced from PubChem (CID 10859735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).