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

C18H14F6N2O2 — CID 162763740

IUPAC1-[8-[2-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]ethanol
SMILESCC(O)c1cn2cc(C(F)(F)F)cc(-c3ccccc3OCC(F)(F)F)c2n1
InChIInChI=1S/C18H14F6N2O2/c1-10(27)14-8-26-7-11(18(22,23)24)6-13(16(26)25-14)12-4-2-3-5-15(12)28-9-17(19,20)21/h2-8,10,27H,9H2,1H3
InChIKeyWILQWCPQVHTGBG-UHFFFAOYSA-N
MW404.31 g/mol
LogP5.01
Rot. Bonds4

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

1-[8-[2-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]ethanol (PubChem CID 162763740) has the molecular formula C18H14F6N2O2 and a molecular weight of 404.31 g/mol. Its IUPAC name is 1-[8-[2-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]ethanol.

Molecular Properties

Compound Name1-[8-[2-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]ethanol
PubChem CID162763740
Molecular FormulaC18H14F6N2O2
Molecular Weight404.31 g/mol
Exact Mass404.10
IUPAC Name1-[8-[2-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]ethanol
SMILESCC(O)c1cn2cc(C(F)(F)F)cc(-c3ccccc3OCC(F)(F)F)c2n1
InChIInChI=1S/C18H14F6N2O2/c1-10(27)14-8-26-7-11(18(22,23)24)6-13(16(26)25-14)12-4-2-3-5-15(12)28-9-17(19,20)21/h2-8,10,27H,9H2,1H3
InChIKeyWILQWCPQVHTGBG-UHFFFAOYSA-N
XLogP5.01
TPSA46.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500404.31
LogP ≤ 55.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[8-[2-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]ethanol with MolForge

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Related Compounds

Sch 28080
CID 108137
7-Methyl-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]-6-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
CID 146659124
2-(4-Ethoxyphenyl)imidazo[1,2-a]pyridine
CID 720519
2-(4-Propoxyphenyl)imidazo[1,2-a]pyridine
CID 2876085
3-(4-Propan-2-yloxyphenyl)-6-(6-propan-2-yloxy-3-pyridinyl)imidazo[1,2-a]pyridine
CID 134179257
6-(4-Propan-2-yloxyphenyl)-3-(6-propan-2-yloxy-3-pyridinyl)imidazo[1,2-a]pyridine
CID 134179269
7-Methyl-3,6-bis(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
CID 134179283
3-(4-Cyclopropyloxyphenyl)-6-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
CID 134179286
5-Methyl-3,6-bis(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
CID 134179296
3-[4-[(2-Methylpropan-2-yl)oxy]phenyl]-6-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
CID 134179301
3,6-Bis(4-isopropoxyphenyl)imidazo[1,2-a]pyridine
CID 134179604
6-(2-Methyl-4-propan-2-yloxyphenyl)-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
CID 134179844

Frequently Asked Questions

What is the IUPAC name of 1-[8-[2-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]ethanol?
The IUPAC name of 1-[8-[2-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]ethanol (CID 162763740) is 1-[8-[2-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]ethanol.
What is the SMILES notation for 1-[8-[2-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]ethanol?
The canonical SMILES for 1-[8-[2-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]ethanol is CC(O)c1cn2cc(C(F)(F)F)cc(-c3ccccc3OCC(F)(F)F)c2n1.
What is the InChIKey of 1-[8-[2-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]ethanol?
The InChIKey is WILQWCPQVHTGBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14F6N2O2/c1-10(27)14-8-26-7-11(18(22,23)24)6-13(16(26)25-14)12-4-2-3-5-15(12)28-9-17(19,20)21/h2-8,10,27H,9H2,1H3.
What are the key properties of 1-[8-[2-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]ethanol?
1-[8-[2-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]ethanol has a molecular weight of 404.31 g/mol, XLogP of 5.01, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[8-[2-(2,2,2-trifluoroethoxy)phenyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]ethanol is sourced from PubChem (CID 162763740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).