3-(difluoromethoxy)pyridine

C6H5F2NO — CID 18954644

IUPAC3-(difluoromethoxy)pyridine
SMILESFC(F)Oc1cccnc1
InChIInChI=1S/C6H5F2NO/c7-6(8)10-5-2-1-3-9-4-5/h1-4,6H
InChIKeyIUTBESJQBGXNPC-UHFFFAOYSA-N
MW145.11 g/mol
LogP1.68
Rot. Bonds2

About 3-(difluoromethoxy)pyridine

3-(difluoromethoxy)pyridine (PubChem CID 18954644) has the molecular formula C6H5F2NO and a molecular weight of 145.11 g/mol. Its IUPAC name is 3-(difluoromethoxy)pyridine.

Molecular Properties

Compound Name3-(difluoromethoxy)pyridine
PubChem CID18954644
Molecular FormulaC6H5F2NO
Molecular Weight145.11 g/mol
Exact Mass145.03
IUPAC Name3-(difluoromethoxy)pyridine
SMILESFC(F)Oc1cccnc1
InChIInChI=1S/C6H5F2NO/c7-6(8)10-5-2-1-3-9-4-5/h1-4,6H
InChIKeyIUTBESJQBGXNPC-UHFFFAOYSA-N
XLogP1.68
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.11
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(difluoromethoxy)pyridine?
The IUPAC name of 3-(difluoromethoxy)pyridine (CID 18954644) is 3-(difluoromethoxy)pyridine.
What is the SMILES notation for 3-(difluoromethoxy)pyridine?
The canonical SMILES for 3-(difluoromethoxy)pyridine is FC(F)Oc1cccnc1.
What is the InChIKey of 3-(difluoromethoxy)pyridine?
The InChIKey is IUTBESJQBGXNPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5F2NO/c7-6(8)10-5-2-1-3-9-4-5/h1-4,6H.
What are the key properties of 3-(difluoromethoxy)pyridine?
3-(difluoromethoxy)pyridine has a molecular weight of 145.11 g/mol, XLogP of 1.68, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(difluoromethoxy)pyridine is sourced from PubChem (CID 18954644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).