(2,5-dimethoxyphenyl)-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]methanol

C19H17F3N2O3 — CID 46942878

IUPAC(2,5-dimethoxyphenyl)-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]methanol
SMILESCOc1ccc(OC)c(C(O)c2ncc(-c3cccc(C(F)(F)F)c3)[nH]2)c1
InChIInChI=1S/C19H17F3N2O3/c1-26-13-6-7-16(27-2)14(9-13)17(25)18-23-10-15(24-18)11-4-3-5-12(8-11)19(20,21)22/h3-10,17,25H,1-2H3,(H,23,24)
InChIKeyZTIPOUSWKIEXKU-UHFFFAOYSA-N
MW378.35 g/mol
LogP4.19
Rot. Bonds5

About (2,5-dimethoxyphenyl)-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]methanol

(2,5-dimethoxyphenyl)-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]methanol (PubChem CID 46942878) has the molecular formula C19H17F3N2O3 and a molecular weight of 378.35 g/mol. Its IUPAC name is (2,5-dimethoxyphenyl)-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]methanol.

Molecular Properties

Compound Name(2,5-dimethoxyphenyl)-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]methanol
PubChem CID46942878
Molecular FormulaC19H17F3N2O3
Molecular Weight378.35 g/mol
Exact Mass378.12
IUPAC Name(2,5-dimethoxyphenyl)-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]methanol
SMILESCOc1ccc(OC)c(C(O)c2ncc(-c3cccc(C(F)(F)F)c3)[nH]2)c1
InChIInChI=1S/C19H17F3N2O3/c1-26-13-6-7-16(27-2)14(9-13)17(25)18-23-10-15(24-18)11-4-3-5-12(8-11)19(20,21)22/h3-10,17,25H,1-2H3,(H,23,24)
InChIKeyZTIPOUSWKIEXKU-UHFFFAOYSA-N
XLogP4.19
TPSA67.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.35
LogP ≤ 54.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

phenyl-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]methanol
CID 46942875
(4-fluorophenyl)-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]methanol
CID 46943500
5-(3-methoxyphenyl)-2-propan-2-yl-1H-imidazole
CID 166267490
(3-chloro-5-fluorophenyl)-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]methanol
CID 46943479
[5-(3-methoxyphenyl)-1H-imidazol-2-yl]-(3-methylthiophen-2-yl)methanol
CID 155902159
2-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]pentan-1-amine
CID 65230757
2-amino-2-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]acetic acid
CID 116881507
2-(5-methoxy-2-methyl-1H-indol-3-yl)-N-[(1S)-7-oxo-1-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]nonyl]acetamide;2,2,2-trifluoroacetic acid
CID 171928638
1-[(1R)-1-(2,5-dimethoxyphenyl)ethyl]-3-[3-(trifluoromethyl)phenyl]thiourea
CID 2210844
(2,5-dimethoxyphenyl)-(3-fluorophenyl)methanol
CID 61099370
3-methoxy-6-(trifluoromethyl)-2-[3-(trifluoromethyl)phenyl]pyridine
CID 134627212
(2,5-dimethoxyphenyl)-(2-fluoro-6-methoxyphenyl)methanol
CID 65433281

Frequently Asked Questions

What is the IUPAC name of (2,5-dimethoxyphenyl)-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]methanol?
The IUPAC name of (2,5-dimethoxyphenyl)-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]methanol (CID 46942878) is (2,5-dimethoxyphenyl)-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]methanol.
What is the SMILES notation for (2,5-dimethoxyphenyl)-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]methanol?
The canonical SMILES for (2,5-dimethoxyphenyl)-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]methanol is COc1ccc(OC)c(C(O)c2ncc(-c3cccc(C(F)(F)F)c3)[nH]2)c1.
What is the InChIKey of (2,5-dimethoxyphenyl)-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]methanol?
The InChIKey is ZTIPOUSWKIEXKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17F3N2O3/c1-26-13-6-7-16(27-2)14(9-13)17(25)18-23-10-15(24-18)11-4-3-5-12(8-11)19(20,21)22/h3-10,17,25H,1-2H3,(H,23,24).
What are the key properties of (2,5-dimethoxyphenyl)-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]methanol?
(2,5-dimethoxyphenyl)-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]methanol has a molecular weight of 378.35 g/mol, XLogP of 4.19, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dimethoxyphenyl)-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]methanol is sourced from PubChem (CID 46942878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).