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

C19H17F3N2O — CID 46942827

IUPAC(4-ethylphenyl)-[5-[4-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]methanol
SMILESCCc1ccc(C(O)c2ncc(-c3ccc(C(F)(F)F)cc3)[nH]2)cc1
InChIInChI=1S/C19H17F3N2O/c1-2-12-3-5-14(6-4-12)17(25)18-23-11-16(24-18)13-7-9-15(10-8-13)19(20,21)22/h3-11,17,25H,2H2,1H3,(H,23,24)
InChIKeyOOTSNCPHZLCRSC-UHFFFAOYSA-N
MW346.35 g/mol
LogP4.74
Rot. Bonds4

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

(4-ethylphenyl)-[5-[4-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]methanol (PubChem CID 46942827) has the molecular formula C19H17F3N2O and a molecular weight of 346.35 g/mol. Its IUPAC name is (4-ethylphenyl)-[5-[4-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]methanol.

Molecular Properties

Compound Name(4-ethylphenyl)-[5-[4-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]methanol
PubChem CID46942827
Molecular FormulaC19H17F3N2O
Molecular Weight346.35 g/mol
Exact Mass346.13
IUPAC Name(4-ethylphenyl)-[5-[4-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]methanol
SMILESCCc1ccc(C(O)c2ncc(-c3ccc(C(F)(F)F)cc3)[nH]2)cc1
InChIInChI=1S/C19H17F3N2O/c1-2-12-3-5-14(6-4-12)17(25)18-23-11-16(24-18)13-7-9-15(10-8-13)19(20,21)22/h3-11,17,25H,2H2,1H3,(H,23,24)
InChIKeyOOTSNCPHZLCRSC-UHFFFAOYSA-N
XLogP4.74
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.35
LogP ≤ 54.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4-ethylphenyl)-[5-[4-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]methanol?
The IUPAC name of (4-ethylphenyl)-[5-[4-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]methanol (CID 46942827) is (4-ethylphenyl)-[5-[4-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]methanol.
What is the SMILES notation for (4-ethylphenyl)-[5-[4-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]methanol?
The canonical SMILES for (4-ethylphenyl)-[5-[4-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]methanol is CCc1ccc(C(O)c2ncc(-c3ccc(C(F)(F)F)cc3)[nH]2)cc1.
What is the InChIKey of (4-ethylphenyl)-[5-[4-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]methanol?
The InChIKey is OOTSNCPHZLCRSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17F3N2O/c1-2-12-3-5-14(6-4-12)17(25)18-23-11-16(24-18)13-7-9-15(10-8-13)19(20,21)22/h3-11,17,25H,2H2,1H3,(H,23,24).
What are the key properties of (4-ethylphenyl)-[5-[4-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]methanol?
(4-ethylphenyl)-[5-[4-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]methanol has a molecular weight of 346.35 g/mol, XLogP of 4.74, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethylphenyl)-[5-[4-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]methanol is sourced from PubChem (CID 46942827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).