5-(difluoromethoxy)-2-fluoropyridine

C6H4F3NO — CID 14665053

IUPAC5-(difluoromethoxy)-2-fluoropyridine
SMILESFc1ccc(OC(F)F)cn1
InChIInChI=1S/C6H4F3NO/c7-5-2-1-4(3-10-5)11-6(8)9/h1-3,6H
InChIKeyYAYNBQKHBNEVLX-UHFFFAOYSA-N
MW163.10 g/mol
LogP1.82
Rot. Bonds2

About 5-(difluoromethoxy)-2-fluoropyridine

5-(difluoromethoxy)-2-fluoropyridine (PubChem CID 14665053) has the molecular formula C6H4F3NO and a molecular weight of 163.10 g/mol. Its IUPAC name is 5-(difluoromethoxy)-2-fluoropyridine.

Molecular Properties

Compound Name5-(difluoromethoxy)-2-fluoropyridine
PubChem CID14665053
Molecular FormulaC6H4F3NO
Molecular Weight163.10 g/mol
Exact Mass163.02
IUPAC Name5-(difluoromethoxy)-2-fluoropyridine
SMILESFc1ccc(OC(F)F)cn1
InChIInChI=1S/C6H4F3NO/c7-5-2-1-4(3-10-5)11-6(8)9/h1-3,6H
InChIKeyYAYNBQKHBNEVLX-UHFFFAOYSA-N
XLogP1.82
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.10
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 5-(difluoromethoxy)-2-fluoropyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-(difluoromethoxy)-2-fluoropyridine?
The IUPAC name of 5-(difluoromethoxy)-2-fluoropyridine (CID 14665053) is 5-(difluoromethoxy)-2-fluoropyridine.
What is the SMILES notation for 5-(difluoromethoxy)-2-fluoropyridine?
The canonical SMILES for 5-(difluoromethoxy)-2-fluoropyridine is Fc1ccc(OC(F)F)cn1.
What is the InChIKey of 5-(difluoromethoxy)-2-fluoropyridine?
The InChIKey is YAYNBQKHBNEVLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4F3NO/c7-5-2-1-4(3-10-5)11-6(8)9/h1-3,6H.
What are the key properties of 5-(difluoromethoxy)-2-fluoropyridine?
5-(difluoromethoxy)-2-fluoropyridine has a molecular weight of 163.10 g/mol, XLogP of 1.82, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(difluoromethoxy)-2-fluoropyridine is sourced from PubChem (CID 14665053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).