6-piperazin-1-yl-[1,2,4]triazolo[4,3-b]pyridazine

C9H12N6 — CID 45496235

IUPAC6-piperazin-1-yl-[1,2,4]triazolo[4,3-b]pyridazine
SMILESc1cc2nncn2nc1N1CCNCC1
InChIInChI=1S/C9H12N6/c1-2-9(14-5-3-10-4-6-14)13-15-7-11-12-8(1)15/h1-2,7,10H,3-6H2
InChIKeyRZINTGMACQMYCE-UHFFFAOYSA-N
MW204.24 g/mol
LogP-0.47
Rot. Bonds1

About 6-piperazin-1-yl-[1,2,4]triazolo[4,3-b]pyridazine

6-piperazin-1-yl-[1,2,4]triazolo[4,3-b]pyridazine (PubChem CID 45496235) has the molecular formula C9H12N6 and a molecular weight of 204.24 g/mol. Its IUPAC name is 6-piperazin-1-yl-[1,2,4]triazolo[4,3-b]pyridazine.

Molecular Properties

Compound Name6-piperazin-1-yl-[1,2,4]triazolo[4,3-b]pyridazine
PubChem CID45496235
Molecular FormulaC9H12N6
Molecular Weight204.24 g/mol
Exact Mass204.11
IUPAC Name6-piperazin-1-yl-[1,2,4]triazolo[4,3-b]pyridazine
SMILESc1cc2nncn2nc1N1CCNCC1
InChIInChI=1S/C9H12N6/c1-2-9(14-5-3-10-4-6-14)13-15-7-11-12-8(1)15/h1-2,7,10H,3-6H2
InChIKeyRZINTGMACQMYCE-UHFFFAOYSA-N
XLogP-0.47
TPSA58.35 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.24
LogP ≤ 5-0.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

{[1,2,4]Triazolo[4,3-b]pyridazin-6-yl}hydrazine
CID 4264519
Zindotrine
CID 41856
6-(3-Methylpiperidin-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine
CID 2807627
3-Methyl-6-(1-pyrrolidinyl)-[1,2,4]triazolo[4,3-b]pyridazine
CID 869579
3-Methyl-6-(4-methylpiperazin-1-yl)[1,2,4]triazolo[4,3-b]pyridazine
CID 869844
5-(4-Mesyl-1-piperazinyl)-1,2,3a,4-tetraazaindene
CID 25889761
6-Pyrrolidin-1-yl-[1,2,4]triazolo[4,3-b]pyridazine
CID 647722
N,3-dimethyl-N-(2-piperidin-4-ylethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine
CID 164614401
6-Piperidin-1-yl-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazine
CID 683253
N-cyclohexyl-2-[4-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)piperazin-1-yl]acetamide
CID 53608569
N-cyclopentyl-2-[4-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)piperazin-1-yl]acetamide
CID 53614122
4-{[1,2,4]Triazolo[4,3-B]pyridazin-6-YL}morpholine
CID 2807620

Frequently Asked Questions

What is the IUPAC name of 6-piperazin-1-yl-[1,2,4]triazolo[4,3-b]pyridazine?
The IUPAC name of 6-piperazin-1-yl-[1,2,4]triazolo[4,3-b]pyridazine (CID 45496235) is 6-piperazin-1-yl-[1,2,4]triazolo[4,3-b]pyridazine.
What is the SMILES notation for 6-piperazin-1-yl-[1,2,4]triazolo[4,3-b]pyridazine?
The canonical SMILES for 6-piperazin-1-yl-[1,2,4]triazolo[4,3-b]pyridazine is c1cc2nncn2nc1N1CCNCC1.
What is the InChIKey of 6-piperazin-1-yl-[1,2,4]triazolo[4,3-b]pyridazine?
The InChIKey is RZINTGMACQMYCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N6/c1-2-9(14-5-3-10-4-6-14)13-15-7-11-12-8(1)15/h1-2,7,10H,3-6H2.
What are the key properties of 6-piperazin-1-yl-[1,2,4]triazolo[4,3-b]pyridazine?
6-piperazin-1-yl-[1,2,4]triazolo[4,3-b]pyridazine has a molecular weight of 204.24 g/mol, XLogP of -0.47, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-piperazin-1-yl-[1,2,4]triazolo[4,3-b]pyridazine is sourced from PubChem (CID 45496235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).