tetrazolo[1,5-b]pyridazine

C4H3N5 — CID 548600

IUPACtetrazolo[1,5-b]pyridazine
SMILESc1cnn2nnnc2c1
InChIInChI=1S/C4H3N5/c1-2-4-6-7-8-9(4)5-3-1/h1-3H
InChIKeyLWFUGGGWLUMXQZ-UHFFFAOYSA-N
MW121.10 g/mol
LogP-0.48
Rot. Bonds

About tetrazolo[1,5-b]pyridazine

tetrazolo[1,5-b]pyridazine (PubChem CID 548600) has the molecular formula C4H3N5 and a molecular weight of 121.10 g/mol. Its IUPAC name is tetrazolo[1,5-b]pyridazine.

Molecular Properties

Compound Nametetrazolo[1,5-b]pyridazine
PubChem CID548600
Molecular FormulaC4H3N5
Molecular Weight121.10 g/mol
Exact Mass121.04
IUPAC Nametetrazolo[1,5-b]pyridazine
SMILESc1cnn2nnnc2c1
InChIInChI=1S/C4H3N5/c1-2-4-6-7-8-9(4)5-3-1/h1-3H
InChIKeyLWFUGGGWLUMXQZ-UHFFFAOYSA-N
XLogP-0.48
TPSA55.97 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.10
LogP ≤ 5-0.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of tetrazolo[1,5-b]pyridazine?
The IUPAC name of tetrazolo[1,5-b]pyridazine (CID 548600) is tetrazolo[1,5-b]pyridazine.
What is the SMILES notation for tetrazolo[1,5-b]pyridazine?
The canonical SMILES for tetrazolo[1,5-b]pyridazine is c1cnn2nnnc2c1.
What is the InChIKey of tetrazolo[1,5-b]pyridazine?
The InChIKey is LWFUGGGWLUMXQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H3N5/c1-2-4-6-7-8-9(4)5-3-1/h1-3H.
What are the key properties of tetrazolo[1,5-b]pyridazine?
tetrazolo[1,5-b]pyridazine has a molecular weight of 121.10 g/mol, XLogP of -0.48, 0 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for tetrazolo[1,5-b]pyridazine is sourced from PubChem (CID 548600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).