3-(difluoromethoxy)-5-fluoropyridazine

C5H3F3N2O — CID 91333595

IUPAC3-(difluoromethoxy)-5-fluoropyridazine
SMILESFc1cnnc(OC(F)F)c1
InChIInChI=1S/C5H3F3N2O/c6-3-1-4(10-9-2-3)11-5(7)8/h1-2,5H
InChIKeyHBMQHLLJJAJGCA-UHFFFAOYSA-N
MW164.09 g/mol
LogP1.22
Rot. Bonds2

About 3-(difluoromethoxy)-5-fluoropyridazine

3-(difluoromethoxy)-5-fluoropyridazine (PubChem CID 91333595) has the molecular formula C5H3F3N2O and a molecular weight of 164.09 g/mol. Its IUPAC name is 3-(difluoromethoxy)-5-fluoropyridazine.

Molecular Properties

Compound Name3-(difluoromethoxy)-5-fluoropyridazine
PubChem CID91333595
Molecular FormulaC5H3F3N2O
Molecular Weight164.09 g/mol
Exact Mass164.02
IUPAC Name3-(difluoromethoxy)-5-fluoropyridazine
SMILESFc1cnnc(OC(F)F)c1
InChIInChI=1S/C5H3F3N2O/c6-3-1-4(10-9-2-3)11-5(7)8/h1-2,5H
InChIKeyHBMQHLLJJAJGCA-UHFFFAOYSA-N
XLogP1.22
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.09
LogP ≤ 51.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(difluoromethoxy)-5-fluoropyridazine?
The IUPAC name of 3-(difluoromethoxy)-5-fluoropyridazine (CID 91333595) is 3-(difluoromethoxy)-5-fluoropyridazine.
What is the SMILES notation for 3-(difluoromethoxy)-5-fluoropyridazine?
The canonical SMILES for 3-(difluoromethoxy)-5-fluoropyridazine is Fc1cnnc(OC(F)F)c1.
What is the InChIKey of 3-(difluoromethoxy)-5-fluoropyridazine?
The InChIKey is HBMQHLLJJAJGCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H3F3N2O/c6-3-1-4(10-9-2-3)11-5(7)8/h1-2,5H.
What are the key properties of 3-(difluoromethoxy)-5-fluoropyridazine?
3-(difluoromethoxy)-5-fluoropyridazine has a molecular weight of 164.09 g/mol, XLogP of 1.22, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(difluoromethoxy)-5-fluoropyridazine is sourced from PubChem (CID 91333595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).