3,6-bis(4-methylphenoxy)pyridazine

C18H16N2O2 — CID 6408790

IUPAC3,6-bis(4-methylphenoxy)pyridazine
SMILESCc1ccc(Oc2ccc(Oc3ccc(C)cc3)nn2)cc1
InChIInChI=1S/C18H16N2O2/c1-13-3-7-15(8-4-13)21-17-11-12-18(20-19-17)22-16-9-5-14(2)6-10-16/h3-12H,1-2H3
InChIKeyGPGPKKVMONNVSP-UHFFFAOYSA-N
MW292.34 g/mol
LogP4.68
Rot. Bonds4

About 3,6-bis(4-methylphenoxy)pyridazine

3,6-bis(4-methylphenoxy)pyridazine (PubChem CID 6408790) has the molecular formula C18H16N2O2 and a molecular weight of 292.34 g/mol. Its IUPAC name is 3,6-bis(4-methylphenoxy)pyridazine.

Molecular Properties

Compound Name3,6-bis(4-methylphenoxy)pyridazine
PubChem CID6408790
Molecular FormulaC18H16N2O2
Molecular Weight292.34 g/mol
Exact Mass292.12
IUPAC Name3,6-bis(4-methylphenoxy)pyridazine
SMILESCc1ccc(Oc2ccc(Oc3ccc(C)cc3)nn2)cc1
InChIInChI=1S/C18H16N2O2/c1-13-3-7-15(8-4-13)21-17-11-12-18(20-19-17)22-16-9-5-14(2)6-10-16/h3-12H,1-2H3
InChIKeyGPGPKKVMONNVSP-UHFFFAOYSA-N
XLogP4.68
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 54.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3,6-bis(4-methylphenoxy)pyridazine?
The IUPAC name of 3,6-bis(4-methylphenoxy)pyridazine (CID 6408790) is 3,6-bis(4-methylphenoxy)pyridazine.
What is the SMILES notation for 3,6-bis(4-methylphenoxy)pyridazine?
The canonical SMILES for 3,6-bis(4-methylphenoxy)pyridazine is Cc1ccc(Oc2ccc(Oc3ccc(C)cc3)nn2)cc1.
What is the InChIKey of 3,6-bis(4-methylphenoxy)pyridazine?
The InChIKey is GPGPKKVMONNVSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O2/c1-13-3-7-15(8-4-13)21-17-11-12-18(20-19-17)22-16-9-5-14(2)6-10-16/h3-12H,1-2H3.
What are the key properties of 3,6-bis(4-methylphenoxy)pyridazine?
3,6-bis(4-methylphenoxy)pyridazine has a molecular weight of 292.34 g/mol, XLogP of 4.68, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-bis(4-methylphenoxy)pyridazine is sourced from PubChem (CID 6408790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).