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

C11H9F3N2O2 — CID 63108258

IUPAC[2-[2-(trifluoromethoxy)phenyl]-1H-imidazol-5-yl]methanol
SMILESOCc1cnc(-c2ccccc2OC(F)(F)F)[nH]1
InChIInChI=1S/C11H9F3N2O2/c12-11(13,14)18-9-4-2-1-3-8(9)10-15-5-7(6-17)16-10/h1-5,17H,6H2,(H,15,16)
InChIKeyFRPQGZUNYOUAOD-UHFFFAOYSA-N
MW258.20 g/mol
LogP2.47
Rot. Bonds3

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

[2-[2-(trifluoromethoxy)phenyl]-1H-imidazol-5-yl]methanol (PubChem CID 63108258) has the molecular formula C11H9F3N2O2 and a molecular weight of 258.20 g/mol. Its IUPAC name is [2-[2-(trifluoromethoxy)phenyl]-1H-imidazol-5-yl]methanol.

Molecular Properties

Compound Name[2-[2-(trifluoromethoxy)phenyl]-1H-imidazol-5-yl]methanol
PubChem CID63108258
Molecular FormulaC11H9F3N2O2
Molecular Weight258.20 g/mol
Exact Mass258.06
IUPAC Name[2-[2-(trifluoromethoxy)phenyl]-1H-imidazol-5-yl]methanol
SMILESOCc1cnc(-c2ccccc2OC(F)(F)F)[nH]1
InChIInChI=1S/C11H9F3N2O2/c12-11(13,14)18-9-4-2-1-3-8(9)10-15-5-7(6-17)16-10/h1-5,17H,6H2,(H,15,16)
InChIKeyFRPQGZUNYOUAOD-UHFFFAOYSA-N
XLogP2.47
TPSA58.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.20
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-iodo-2-[2-(trifluoromethoxy)phenyl]-1H-pyrimidin-6-one
CID 66313546
[3,5-bis[2-(trifluoromethoxy)phenyl]-2-pyridinyl]methanol
CID 134623328
1-(trifluoromethoxy)-2-[2-(trifluoromethoxy)phenyl]benzene
CID 18785200
[2,5-bis[2-(trifluoromethoxy)phenyl]-4-pyridinyl]methanol
CID 134617951
[2-[2-(trifluoromethoxy)phenyl]-4-pyridinyl]methanol
CID 118802410
3,4,5-tris[2-(trifluoromethoxy)phenyl]pyridine
CID 134622953
2-[2-(2-methoxyphenyl)-1H-imidazol-5-yl]acetic acid
CID 82289480
[2-fluoro-6-[2-(trifluoromethoxy)phenyl]-3-pyridinyl]methanol
CID 133089327
4-methoxy-6-[2-(trifluoromethoxy)phenyl]-1H-1,3,5-triazin-2-one
CID 106514778
5-methyl-6-[2-(trifluoromethoxy)phenyl]-1H-pyrimidine-2-thione
CID 106514804
6-[2-(trifluoromethoxy)phenyl]-1H-pyrimidine-2-thione
CID 106514791
5-ethyl-4-methyl-2-[2-(trifluoromethoxy)phenyl]-1H-pyrimidin-6-one
CID 135996623

Frequently Asked Questions

What is the IUPAC name of [2-[2-(trifluoromethoxy)phenyl]-1H-imidazol-5-yl]methanol?
The IUPAC name of [2-[2-(trifluoromethoxy)phenyl]-1H-imidazol-5-yl]methanol (CID 63108258) is [2-[2-(trifluoromethoxy)phenyl]-1H-imidazol-5-yl]methanol.
What is the SMILES notation for [2-[2-(trifluoromethoxy)phenyl]-1H-imidazol-5-yl]methanol?
The canonical SMILES for [2-[2-(trifluoromethoxy)phenyl]-1H-imidazol-5-yl]methanol is OCc1cnc(-c2ccccc2OC(F)(F)F)[nH]1.
What is the InChIKey of [2-[2-(trifluoromethoxy)phenyl]-1H-imidazol-5-yl]methanol?
The InChIKey is FRPQGZUNYOUAOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9F3N2O2/c12-11(13,14)18-9-4-2-1-3-8(9)10-15-5-7(6-17)16-10/h1-5,17H,6H2,(H,15,16).
What are the key properties of [2-[2-(trifluoromethoxy)phenyl]-1H-imidazol-5-yl]methanol?
[2-[2-(trifluoromethoxy)phenyl]-1H-imidazol-5-yl]methanol has a molecular weight of 258.20 g/mol, XLogP of 2.47, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[2-(trifluoromethoxy)phenyl]-1H-imidazol-5-yl]methanol is sourced from PubChem (CID 63108258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).