2-[[6-(trifluoromethyl)-2-pyridinyl]oxy]ethanol

C8H8F3NO2 — CID 84596667

IUPAC2-[[6-(trifluoromethyl)-2-pyridinyl]oxy]ethanol
SMILESOCCOc1cccc(C(F)(F)F)n1
InChIInChI=1S/C8H8F3NO2/c9-8(10,11)6-2-1-3-7(12-6)14-5-4-13/h1-3,13H,4-5H2
InChIKeyNAAGOZCFPCNEND-UHFFFAOYSA-N
MW207.15 g/mol
LogP1.47
Rot. Bonds3

About 2-[[6-(trifluoromethyl)-2-pyridinyl]oxy]ethanol

2-[[6-(trifluoromethyl)-2-pyridinyl]oxy]ethanol (PubChem CID 84596667) has the molecular formula C8H8F3NO2 and a molecular weight of 207.15 g/mol. Its IUPAC name is 2-[[6-(trifluoromethyl)-2-pyridinyl]oxy]ethanol.

Molecular Properties

Compound Name2-[[6-(trifluoromethyl)-2-pyridinyl]oxy]ethanol
PubChem CID84596667
Molecular FormulaC8H8F3NO2
Molecular Weight207.15 g/mol
Exact Mass207.05
IUPAC Name2-[[6-(trifluoromethyl)-2-pyridinyl]oxy]ethanol
SMILESOCCOc1cccc(C(F)(F)F)n1
InChIInChI=1S/C8H8F3NO2/c9-8(10,11)6-2-1-3-7(12-6)14-5-4-13/h1-3,13H,4-5H2
InChIKeyNAAGOZCFPCNEND-UHFFFAOYSA-N
XLogP1.47
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.15
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[[6-(trifluoromethyl)-2-pyridinyl]oxy]ethanol?
The IUPAC name of 2-[[6-(trifluoromethyl)-2-pyridinyl]oxy]ethanol (CID 84596667) is 2-[[6-(trifluoromethyl)-2-pyridinyl]oxy]ethanol.
What is the SMILES notation for 2-[[6-(trifluoromethyl)-2-pyridinyl]oxy]ethanol?
The canonical SMILES for 2-[[6-(trifluoromethyl)-2-pyridinyl]oxy]ethanol is OCCOc1cccc(C(F)(F)F)n1.
What is the InChIKey of 2-[[6-(trifluoromethyl)-2-pyridinyl]oxy]ethanol?
The InChIKey is NAAGOZCFPCNEND-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F3NO2/c9-8(10,11)6-2-1-3-7(12-6)14-5-4-13/h1-3,13H,4-5H2.
What are the key properties of 2-[[6-(trifluoromethyl)-2-pyridinyl]oxy]ethanol?
2-[[6-(trifluoromethyl)-2-pyridinyl]oxy]ethanol has a molecular weight of 207.15 g/mol, XLogP of 1.47, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[6-(trifluoromethyl)-2-pyridinyl]oxy]ethanol is sourced from PubChem (CID 84596667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).