3-fluoro-5-(trifluoromethoxy)pyridine

C6H3F4NO — CID 91532712

IUPAC3-fluoro-5-(trifluoromethoxy)pyridine
SMILESFc1cncc(OC(F)(F)F)c1
InChIInChI=1S/C6H3F4NO/c7-4-1-5(3-11-2-4)12-6(8,9)10/h1-3H
InChIKeyMXYUUAOMYBQSEP-UHFFFAOYSA-N
MW181.09 g/mol
LogP2.12
Rot. Bonds1

About 3-fluoro-5-(trifluoromethoxy)pyridine

3-fluoro-5-(trifluoromethoxy)pyridine (PubChem CID 91532712) has the molecular formula C6H3F4NO and a molecular weight of 181.09 g/mol. Its IUPAC name is 3-fluoro-5-(trifluoromethoxy)pyridine.

Molecular Properties

Compound Name3-fluoro-5-(trifluoromethoxy)pyridine
PubChem CID91532712
Molecular FormulaC6H3F4NO
Molecular Weight181.09 g/mol
Exact Mass181.02
IUPAC Name3-fluoro-5-(trifluoromethoxy)pyridine
SMILESFc1cncc(OC(F)(F)F)c1
InChIInChI=1S/C6H3F4NO/c7-4-1-5(3-11-2-4)12-6(8,9)10/h1-3H
InChIKeyMXYUUAOMYBQSEP-UHFFFAOYSA-N
XLogP2.12
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.09
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-5-(trifluoromethoxy)pyridine?
The IUPAC name of 3-fluoro-5-(trifluoromethoxy)pyridine (CID 91532712) is 3-fluoro-5-(trifluoromethoxy)pyridine.
What is the SMILES notation for 3-fluoro-5-(trifluoromethoxy)pyridine?
The canonical SMILES for 3-fluoro-5-(trifluoromethoxy)pyridine is Fc1cncc(OC(F)(F)F)c1.
What is the InChIKey of 3-fluoro-5-(trifluoromethoxy)pyridine?
The InChIKey is MXYUUAOMYBQSEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3F4NO/c7-4-1-5(3-11-2-4)12-6(8,9)10/h1-3H.
What are the key properties of 3-fluoro-5-(trifluoromethoxy)pyridine?
3-fluoro-5-(trifluoromethoxy)pyridine has a molecular weight of 181.09 g/mol, XLogP of 2.12, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-5-(trifluoromethoxy)pyridine is sourced from PubChem (CID 91532712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).