[8-[2-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]methanol

C17H12F6N2O2 — CID 162763762

IUPAC[8-[2-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]methanol
SMILESOCc1cn2cc(C(F)(F)F)cc(-c3ccccc3OCC(F)(F)F)c2n1
InChIInChI=1S/C17H12F6N2O2/c18-16(19,20)9-27-14-4-2-1-3-12(14)13-5-10(17(21,22)23)6-25-7-11(8-26)24-15(13)25/h1-7,26H,8-9H2
InChIKeyGLWPUJVRKVAYEW-UHFFFAOYSA-N
MW390.28 g/mol
LogP4.45
Rot. Bonds4

About [8-[2-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]methanol

[8-[2-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]methanol (PubChem CID 162763762) has the molecular formula C17H12F6N2O2 and a molecular weight of 390.28 g/mol. Its IUPAC name is [8-[2-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]methanol.

Molecular Properties

Compound Name[8-[2-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]methanol
PubChem CID162763762
Molecular FormulaC17H12F6N2O2
Molecular Weight390.28 g/mol
Exact Mass390.08
IUPAC Name[8-[2-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]methanol
SMILESOCc1cn2cc(C(F)(F)F)cc(-c3ccccc3OCC(F)(F)F)c2n1
InChIInChI=1S/C17H12F6N2O2/c18-16(19,20)9-27-14-4-2-1-3-12(14)13-5-10(17(21,22)23)6-25-7-11(8-26)24-15(13)25/h1-7,26H,8-9H2
InChIKeyGLWPUJVRKVAYEW-UHFFFAOYSA-N
XLogP4.45
TPSA46.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.28
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [8-[2-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]methanol?
The IUPAC name of [8-[2-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]methanol (CID 162763762) is [8-[2-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]methanol.
What is the SMILES notation for [8-[2-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]methanol?
The canonical SMILES for [8-[2-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]methanol is OCc1cn2cc(C(F)(F)F)cc(-c3ccccc3OCC(F)(F)F)c2n1.
What is the InChIKey of [8-[2-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]methanol?
The InChIKey is GLWPUJVRKVAYEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12F6N2O2/c18-16(19,20)9-27-14-4-2-1-3-12(14)13-5-10(17(21,22)23)6-25-7-11(8-26)24-15(13)25/h1-7,26H,8-9H2.
What are the key properties of [8-[2-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]methanol?
[8-[2-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]methanol has a molecular weight of 390.28 g/mol, XLogP of 4.45, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [8-[2-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]methanol is sourced from PubChem (CID 162763762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).