2-(thiolan-3-yloxy)-6-(trifluoromethyl)pyridine

C10H10F3NOS — CID 126954786

IUPAC2-(thiolan-3-yloxy)-6-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1cccc(OC2CCSC2)n1
InChIInChI=1S/C10H10F3NOS/c11-10(12,13)8-2-1-3-9(14-8)15-7-4-5-16-6-7/h1-3,7H,4-6H2
InChIKeyFIOVKFITDBTTPE-UHFFFAOYSA-N
MW249.26 g/mol
LogP2.98
Rot. Bonds2

About 2-(thiolan-3-yloxy)-6-(trifluoromethyl)pyridine

2-(thiolan-3-yloxy)-6-(trifluoromethyl)pyridine (PubChem CID 126954786) has the molecular formula C10H10F3NOS and a molecular weight of 249.26 g/mol. Its IUPAC name is 2-(thiolan-3-yloxy)-6-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name2-(thiolan-3-yloxy)-6-(trifluoromethyl)pyridine
PubChem CID126954786
Molecular FormulaC10H10F3NOS
Molecular Weight249.26 g/mol
Exact Mass249.04
IUPAC Name2-(thiolan-3-yloxy)-6-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1cccc(OC2CCSC2)n1
InChIInChI=1S/C10H10F3NOS/c11-10(12,13)8-2-1-3-9(14-8)15-7-4-5-16-6-7/h1-3,7H,4-6H2
InChIKeyFIOVKFITDBTTPE-UHFFFAOYSA-N
XLogP2.98
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.26
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(thiolan-3-yloxy)-6-(trifluoromethyl)pyridine?
The IUPAC name of 2-(thiolan-3-yloxy)-6-(trifluoromethyl)pyridine (CID 126954786) is 2-(thiolan-3-yloxy)-6-(trifluoromethyl)pyridine.
What is the SMILES notation for 2-(thiolan-3-yloxy)-6-(trifluoromethyl)pyridine?
The canonical SMILES for 2-(thiolan-3-yloxy)-6-(trifluoromethyl)pyridine is FC(F)(F)c1cccc(OC2CCSC2)n1.
What is the InChIKey of 2-(thiolan-3-yloxy)-6-(trifluoromethyl)pyridine?
The InChIKey is FIOVKFITDBTTPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F3NOS/c11-10(12,13)8-2-1-3-9(14-8)15-7-4-5-16-6-7/h1-3,7H,4-6H2.
What are the key properties of 2-(thiolan-3-yloxy)-6-(trifluoromethyl)pyridine?
2-(thiolan-3-yloxy)-6-(trifluoromethyl)pyridine has a molecular weight of 249.26 g/mol, XLogP of 2.98, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(thiolan-3-yloxy)-6-(trifluoromethyl)pyridine is sourced from PubChem (CID 126954786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).