3,6-bis(2-ethylimidazol-1-yl)pyridazine

C14H16N6 — CID 12698880

IUPAC3,6-bis(2-ethylimidazol-1-yl)pyridazine
SMILESCCc1nccn1-c1ccc(-n2ccnc2CC)nn1
InChIInChI=1S/C14H16N6/c1-3-11-15-7-9-19(11)13-5-6-14(18-17-13)20-10-8-16-12(20)4-2/h5-10H,3-4H2,1-2H3
InChIKeyZDVVMEYQVBHYQZ-UHFFFAOYSA-N
MW268.32 g/mol
LogP1.97
Rot. Bonds4

About 3,6-bis(2-ethylimidazol-1-yl)pyridazine

3,6-bis(2-ethylimidazol-1-yl)pyridazine (PubChem CID 12698880) has the molecular formula C14H16N6 and a molecular weight of 268.32 g/mol. Its IUPAC name is 3,6-bis(2-ethylimidazol-1-yl)pyridazine.

Molecular Properties

Compound Name3,6-bis(2-ethylimidazol-1-yl)pyridazine
PubChem CID12698880
Molecular FormulaC14H16N6
Molecular Weight268.32 g/mol
Exact Mass268.14
IUPAC Name3,6-bis(2-ethylimidazol-1-yl)pyridazine
SMILESCCc1nccn1-c1ccc(-n2ccnc2CC)nn1
InChIInChI=1S/C14H16N6/c1-3-11-15-7-9-19(11)13-5-6-14(18-17-13)20-10-8-16-12(20)4-2/h5-10H,3-4H2,1-2H3
InChIKeyZDVVMEYQVBHYQZ-UHFFFAOYSA-N
XLogP1.97
TPSA61.42 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3,6-bis(2-ethylimidazol-1-yl)pyridazine?
The IUPAC name of 3,6-bis(2-ethylimidazol-1-yl)pyridazine (CID 12698880) is 3,6-bis(2-ethylimidazol-1-yl)pyridazine.
What is the SMILES notation for 3,6-bis(2-ethylimidazol-1-yl)pyridazine?
The canonical SMILES for 3,6-bis(2-ethylimidazol-1-yl)pyridazine is CCc1nccn1-c1ccc(-n2ccnc2CC)nn1.
What is the InChIKey of 3,6-bis(2-ethylimidazol-1-yl)pyridazine?
The InChIKey is ZDVVMEYQVBHYQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N6/c1-3-11-15-7-9-19(11)13-5-6-14(18-17-13)20-10-8-16-12(20)4-2/h5-10H,3-4H2,1-2H3.
What are the key properties of 3,6-bis(2-ethylimidazol-1-yl)pyridazine?
3,6-bis(2-ethylimidazol-1-yl)pyridazine has a molecular weight of 268.32 g/mol, XLogP of 1.97, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-bis(2-ethylimidazol-1-yl)pyridazine is sourced from PubChem (CID 12698880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).