2,5-difluoro-3-(4-fluorophenoxy)pyridine

C11H6F3NO — CID 145089176

IUPAC2,5-difluoro-3-(4-fluorophenoxy)pyridine
SMILESFc1ccc(Oc2cc(F)cnc2F)cc1
InChIInChI=1S/C11H6F3NO/c12-7-1-3-9(4-2-7)16-10-5-8(13)6-15-11(10)14/h1-6H
InChIKeyPRNHSPYYDJPTTC-UHFFFAOYSA-N
MW225.17 g/mol
LogP3.29
Rot. Bonds2

About 2,5-difluoro-3-(4-fluorophenoxy)pyridine

2,5-difluoro-3-(4-fluorophenoxy)pyridine (PubChem CID 145089176) has the molecular formula C11H6F3NO and a molecular weight of 225.17 g/mol. Its IUPAC name is 2,5-difluoro-3-(4-fluorophenoxy)pyridine.

Molecular Properties

Compound Name2,5-difluoro-3-(4-fluorophenoxy)pyridine
PubChem CID145089176
Molecular FormulaC11H6F3NO
Molecular Weight225.17 g/mol
Exact Mass225.04
IUPAC Name2,5-difluoro-3-(4-fluorophenoxy)pyridine
SMILESFc1ccc(Oc2cc(F)cnc2F)cc1
InChIInChI=1S/C11H6F3NO/c12-7-1-3-9(4-2-7)16-10-5-8(13)6-15-11(10)14/h1-6H
InChIKeyPRNHSPYYDJPTTC-UHFFFAOYSA-N
XLogP3.29
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.17
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,5-difluoro-3-(4-fluorophenoxy)pyridine?
The IUPAC name of 2,5-difluoro-3-(4-fluorophenoxy)pyridine (CID 145089176) is 2,5-difluoro-3-(4-fluorophenoxy)pyridine.
What is the SMILES notation for 2,5-difluoro-3-(4-fluorophenoxy)pyridine?
The canonical SMILES for 2,5-difluoro-3-(4-fluorophenoxy)pyridine is Fc1ccc(Oc2cc(F)cnc2F)cc1.
What is the InChIKey of 2,5-difluoro-3-(4-fluorophenoxy)pyridine?
The InChIKey is PRNHSPYYDJPTTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6F3NO/c12-7-1-3-9(4-2-7)16-10-5-8(13)6-15-11(10)14/h1-6H.
What are the key properties of 2,5-difluoro-3-(4-fluorophenoxy)pyridine?
2,5-difluoro-3-(4-fluorophenoxy)pyridine has a molecular weight of 225.17 g/mol, XLogP of 3.29, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-difluoro-3-(4-fluorophenoxy)pyridine is sourced from PubChem (CID 145089176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).