[6-(trifluoromethoxy)-2-pyridinyl]methanol

C7H6F3NO2 — CID 130088886

IUPAC[6-(trifluoromethoxy)-2-pyridinyl]methanol
SMILESOCc1cccc(OC(F)(F)F)n1
InChIInChI=1S/C7H6F3NO2/c8-7(9,10)13-6-3-1-2-5(4-12)11-6/h1-3,12H,4H2
InChIKeyBADCPQBAPGODRQ-UHFFFAOYSA-N
MW193.12 g/mol
LogP1.47
Rot. Bonds2

About [6-(trifluoromethoxy)-2-pyridinyl]methanol

[6-(trifluoromethoxy)-2-pyridinyl]methanol (PubChem CID 130088886) has the molecular formula C7H6F3NO2 and a molecular weight of 193.12 g/mol. Its IUPAC name is [6-(trifluoromethoxy)-2-pyridinyl]methanol.

Molecular Properties

Compound Name[6-(trifluoromethoxy)-2-pyridinyl]methanol
PubChem CID130088886
Molecular FormulaC7H6F3NO2
Molecular Weight193.12 g/mol
Exact Mass193.04
IUPAC Name[6-(trifluoromethoxy)-2-pyridinyl]methanol
SMILESOCc1cccc(OC(F)(F)F)n1
InChIInChI=1S/C7H6F3NO2/c8-7(9,10)13-6-3-1-2-5(4-12)11-6/h1-3,12H,4H2
InChIKeyBADCPQBAPGODRQ-UHFFFAOYSA-N
XLogP1.47
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.12
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [6-(trifluoromethoxy)-2-pyridinyl]methanol?
The IUPAC name of [6-(trifluoromethoxy)-2-pyridinyl]methanol (CID 130088886) is [6-(trifluoromethoxy)-2-pyridinyl]methanol.
What is the SMILES notation for [6-(trifluoromethoxy)-2-pyridinyl]methanol?
The canonical SMILES for [6-(trifluoromethoxy)-2-pyridinyl]methanol is OCc1cccc(OC(F)(F)F)n1.
What is the InChIKey of [6-(trifluoromethoxy)-2-pyridinyl]methanol?
The InChIKey is BADCPQBAPGODRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F3NO2/c8-7(9,10)13-6-3-1-2-5(4-12)11-6/h1-3,12H,4H2.
What are the key properties of [6-(trifluoromethoxy)-2-pyridinyl]methanol?
[6-(trifluoromethoxy)-2-pyridinyl]methanol has a molecular weight of 193.12 g/mol, XLogP of 1.47, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(trifluoromethoxy)-2-pyridinyl]methanol is sourced from PubChem (CID 130088886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).