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

C8H8F3NO — CID 55266080

IUPAC2-[6-(trifluoromethyl)-2-pyridinyl]ethanol
SMILESOCCc1cccc(C(F)(F)F)n1
InChIInChI=1S/C8H8F3NO/c9-8(10,11)7-3-1-2-6(12-7)4-5-13/h1-3,13H,4-5H2
InChIKeyBVSBBCCBTCZPBN-UHFFFAOYSA-N
MW191.15 g/mol
LogP1.64
Rot. Bonds2

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

2-[6-(trifluoromethyl)-2-pyridinyl]ethanol (PubChem CID 55266080) has the molecular formula C8H8F3NO and a molecular weight of 191.15 g/mol. Its IUPAC name is 2-[6-(trifluoromethyl)-2-pyridinyl]ethanol.

Molecular Properties

Compound Name2-[6-(trifluoromethyl)-2-pyridinyl]ethanol
PubChem CID55266080
Molecular FormulaC8H8F3NO
Molecular Weight191.15 g/mol
Exact Mass191.06
IUPAC Name2-[6-(trifluoromethyl)-2-pyridinyl]ethanol
SMILESOCCc1cccc(C(F)(F)F)n1
InChIInChI=1S/C8H8F3NO/c9-8(10,11)7-3-1-2-6(12-7)4-5-13/h1-3,13H,4-5H2
InChIKeyBVSBBCCBTCZPBN-UHFFFAOYSA-N
XLogP1.64
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.15
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[6-(trifluoromethyl)-2-pyridinyl]ethanol?
The IUPAC name of 2-[6-(trifluoromethyl)-2-pyridinyl]ethanol (CID 55266080) is 2-[6-(trifluoromethyl)-2-pyridinyl]ethanol.
What is the SMILES notation for 2-[6-(trifluoromethyl)-2-pyridinyl]ethanol?
The canonical SMILES for 2-[6-(trifluoromethyl)-2-pyridinyl]ethanol is OCCc1cccc(C(F)(F)F)n1.
What is the InChIKey of 2-[6-(trifluoromethyl)-2-pyridinyl]ethanol?
The InChIKey is BVSBBCCBTCZPBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F3NO/c9-8(10,11)7-3-1-2-6(12-7)4-5-13/h1-3,13H,4-5H2.
What are the key properties of 2-[6-(trifluoromethyl)-2-pyridinyl]ethanol?
2-[6-(trifluoromethyl)-2-pyridinyl]ethanol has a molecular weight of 191.15 g/mol, XLogP of 1.64, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(trifluoromethyl)-2-pyridinyl]ethanol is sourced from PubChem (CID 55266080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).