3-(4-fluorophenoxy)-6-methylpyridazine

C11H9FN2O — CID 22937598

IUPAC3-(4-fluorophenoxy)-6-methylpyridazine
SMILESCc1ccc(Oc2ccc(F)cc2)nn1
InChIInChI=1S/C11H9FN2O/c1-8-2-7-11(14-13-8)15-10-5-3-9(12)4-6-10/h2-7H,1H3
InChIKeyBJVTVNGAYSPUFC-UHFFFAOYSA-N
MW204.20 g/mol
LogP2.72
Rot. Bonds2

About 3-(4-fluorophenoxy)-6-methylpyridazine

3-(4-fluorophenoxy)-6-methylpyridazine (PubChem CID 22937598) has the molecular formula C11H9FN2O and a molecular weight of 204.20 g/mol. Its IUPAC name is 3-(4-fluorophenoxy)-6-methylpyridazine.

Molecular Properties

Compound Name3-(4-fluorophenoxy)-6-methylpyridazine
PubChem CID22937598
Molecular FormulaC11H9FN2O
Molecular Weight204.20 g/mol
Exact Mass204.07
IUPAC Name3-(4-fluorophenoxy)-6-methylpyridazine
SMILESCc1ccc(Oc2ccc(F)cc2)nn1
InChIInChI=1S/C11H9FN2O/c1-8-2-7-11(14-13-8)15-10-5-3-9(12)4-6-10/h2-7H,1H3
InChIKeyBJVTVNGAYSPUFC-UHFFFAOYSA-N
XLogP2.72
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.20
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenoxy)-6-methylpyridazine?
The IUPAC name of 3-(4-fluorophenoxy)-6-methylpyridazine (CID 22937598) is 3-(4-fluorophenoxy)-6-methylpyridazine.
What is the SMILES notation for 3-(4-fluorophenoxy)-6-methylpyridazine?
The canonical SMILES for 3-(4-fluorophenoxy)-6-methylpyridazine is Cc1ccc(Oc2ccc(F)cc2)nn1.
What is the InChIKey of 3-(4-fluorophenoxy)-6-methylpyridazine?
The InChIKey is BJVTVNGAYSPUFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9FN2O/c1-8-2-7-11(14-13-8)15-10-5-3-9(12)4-6-10/h2-7H,1H3.
What are the key properties of 3-(4-fluorophenoxy)-6-methylpyridazine?
3-(4-fluorophenoxy)-6-methylpyridazine has a molecular weight of 204.20 g/mol, XLogP of 2.72, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenoxy)-6-methylpyridazine is sourced from PubChem (CID 22937598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).