3-(difluoromethyl)-6-methoxypyridazine

C6H6F2N2O — CID 86715320

IUPAC3-(difluoromethyl)-6-methoxypyridazine
SMILESCOc1ccc(C(F)F)nn1
InChIInChI=1S/C6H6F2N2O/c1-11-5-3-2-4(6(7)8)9-10-5/h2-3,6H,1H3
InChIKeyZKWOADNJSDNAGT-UHFFFAOYSA-N
MW160.12 g/mol
LogP1.42
Rot. Bonds2

About 3-(difluoromethyl)-6-methoxypyridazine

3-(difluoromethyl)-6-methoxypyridazine (PubChem CID 86715320) has the molecular formula C6H6F2N2O and a molecular weight of 160.12 g/mol. Its IUPAC name is 3-(difluoromethyl)-6-methoxypyridazine.

Molecular Properties

Compound Name3-(difluoromethyl)-6-methoxypyridazine
PubChem CID86715320
Molecular FormulaC6H6F2N2O
Molecular Weight160.12 g/mol
Exact Mass160.04
IUPAC Name3-(difluoromethyl)-6-methoxypyridazine
SMILESCOc1ccc(C(F)F)nn1
InChIInChI=1S/C6H6F2N2O/c1-11-5-3-2-4(6(7)8)9-10-5/h2-3,6H,1H3
InChIKeyZKWOADNJSDNAGT-UHFFFAOYSA-N
XLogP1.42
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.12
LogP ≤ 51.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(difluoromethyl)-6-methoxypyridazine?
The IUPAC name of 3-(difluoromethyl)-6-methoxypyridazine (CID 86715320) is 3-(difluoromethyl)-6-methoxypyridazine.
What is the SMILES notation for 3-(difluoromethyl)-6-methoxypyridazine?
The canonical SMILES for 3-(difluoromethyl)-6-methoxypyridazine is COc1ccc(C(F)F)nn1.
What is the InChIKey of 3-(difluoromethyl)-6-methoxypyridazine?
The InChIKey is ZKWOADNJSDNAGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6F2N2O/c1-11-5-3-2-4(6(7)8)9-10-5/h2-3,6H,1H3.
What are the key properties of 3-(difluoromethyl)-6-methoxypyridazine?
3-(difluoromethyl)-6-methoxypyridazine has a molecular weight of 160.12 g/mol, XLogP of 1.42, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(difluoromethyl)-6-methoxypyridazine is sourced from PubChem (CID 86715320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).