3,6-bis(phenylmethoxy)pyridazine

C18H16N2O2 — CID 68982842

IUPAC3,6-bis(phenylmethoxy)pyridazine
SMILESc1ccc(COc2ccc(OCc3ccccc3)nn2)cc1
InChIInChI=1S/C18H16N2O2/c1-3-7-15(8-4-1)13-21-17-11-12-18(20-19-17)22-14-16-9-5-2-6-10-16/h1-12H,13-14H2
InChIKeyZGKRPSZFVMBILV-UHFFFAOYSA-N
MW292.34 g/mol
LogP3.63
Rot. Bonds6

About 3,6-bis(phenylmethoxy)pyridazine

3,6-bis(phenylmethoxy)pyridazine (PubChem CID 68982842) has the molecular formula C18H16N2O2 and a molecular weight of 292.34 g/mol. Its IUPAC name is 3,6-bis(phenylmethoxy)pyridazine.

Molecular Properties

Compound Name3,6-bis(phenylmethoxy)pyridazine
PubChem CID68982842
Molecular FormulaC18H16N2O2
Molecular Weight292.34 g/mol
Exact Mass292.12
IUPAC Name3,6-bis(phenylmethoxy)pyridazine
SMILESc1ccc(COc2ccc(OCc3ccccc3)nn2)cc1
InChIInChI=1S/C18H16N2O2/c1-3-7-15(8-4-1)13-21-17-11-12-18(20-19-17)22-14-16-9-5-2-6-10-16/h1-12H,13-14H2
InChIKeyZGKRPSZFVMBILV-UHFFFAOYSA-N
XLogP3.63
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3,6-bis(phenylmethoxy)pyridazine?
The IUPAC name of 3,6-bis(phenylmethoxy)pyridazine (CID 68982842) is 3,6-bis(phenylmethoxy)pyridazine.
What is the SMILES notation for 3,6-bis(phenylmethoxy)pyridazine?
The canonical SMILES for 3,6-bis(phenylmethoxy)pyridazine is c1ccc(COc2ccc(OCc3ccccc3)nn2)cc1.
What is the InChIKey of 3,6-bis(phenylmethoxy)pyridazine?
The InChIKey is ZGKRPSZFVMBILV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O2/c1-3-7-15(8-4-1)13-21-17-11-12-18(20-19-17)22-14-16-9-5-2-6-10-16/h1-12H,13-14H2.
What are the key properties of 3,6-bis(phenylmethoxy)pyridazine?
3,6-bis(phenylmethoxy)pyridazine has a molecular weight of 292.34 g/mol, XLogP of 3.63, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-bis(phenylmethoxy)pyridazine is sourced from PubChem (CID 68982842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).