(1R)-1-[6-(trifluoromethoxy)-2-pyridinyl]ethanol

C8H8F3NO2 — CID 170748259

IUPAC(1R)-1-[6-(trifluoromethoxy)-2-pyridinyl]ethanol
SMILESC[C@@H](O)c1cccc(OC(F)(F)F)n1
InChIInChI=1S/C8H8F3NO2/c1-5(13)6-3-2-4-7(12-6)14-8(9,10)11/h2-5,13H,1H3/t5-/m1/s1
InChIKeyFYNVIDSZWXPDGI-RXMQYKEDSA-N
MW207.15 g/mol
LogP2.03
Rot. Bonds2

About (1R)-1-[6-(trifluoromethoxy)-2-pyridinyl]ethanol

(1R)-1-[6-(trifluoromethoxy)-2-pyridinyl]ethanol (PubChem CID 170748259) has the molecular formula C8H8F3NO2 and a molecular weight of 207.15 g/mol. Its IUPAC name is (1R)-1-[6-(trifluoromethoxy)-2-pyridinyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[6-(trifluoromethoxy)-2-pyridinyl]ethanol
PubChem CID170748259
Molecular FormulaC8H8F3NO2
Molecular Weight207.15 g/mol
Exact Mass207.05
IUPAC Name(1R)-1-[6-(trifluoromethoxy)-2-pyridinyl]ethanol
SMILESC[C@@H](O)c1cccc(OC(F)(F)F)n1
InChIInChI=1S/C8H8F3NO2/c1-5(13)6-3-2-4-7(12-6)14-8(9,10)11/h2-5,13H,1H3/t5-/m1/s1
InChIKeyFYNVIDSZWXPDGI-RXMQYKEDSA-N
XLogP2.03
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.15
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-[6-(trifluoromethoxy)-2-pyridinyl]ethanol?
The IUPAC name of (1R)-1-[6-(trifluoromethoxy)-2-pyridinyl]ethanol (CID 170748259) is (1R)-1-[6-(trifluoromethoxy)-2-pyridinyl]ethanol.
What is the SMILES notation for (1R)-1-[6-(trifluoromethoxy)-2-pyridinyl]ethanol?
The canonical SMILES for (1R)-1-[6-(trifluoromethoxy)-2-pyridinyl]ethanol is C[C@@H](O)c1cccc(OC(F)(F)F)n1.
What is the InChIKey of (1R)-1-[6-(trifluoromethoxy)-2-pyridinyl]ethanol?
The InChIKey is FYNVIDSZWXPDGI-RXMQYKEDSA-N. The full InChI is InChI=1S/C8H8F3NO2/c1-5(13)6-3-2-4-7(12-6)14-8(9,10)11/h2-5,13H,1H3/t5-/m1/s1.
What are the key properties of (1R)-1-[6-(trifluoromethoxy)-2-pyridinyl]ethanol?
(1R)-1-[6-(trifluoromethoxy)-2-pyridinyl]ethanol has a molecular weight of 207.15 g/mol, XLogP of 2.03, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[6-(trifluoromethoxy)-2-pyridinyl]ethanol is sourced from PubChem (CID 170748259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).