6-(3,5-dimethylpyrazol-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine

C10H10N6 — CID 702232

IUPAC6-(3,5-dimethylpyrazol-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine
SMILESCc1cc(C)n(-c2ccc3nncn3n2)n1
InChIInChI=1S/C10H10N6/c1-7-5-8(2)16(13-7)10-4-3-9-12-11-6-15(9)14-10/h3-6H,1-2H3
InChIKeyAUQGWZJKGUSFFL-UHFFFAOYSA-N
MW214.23 g/mol
LogP0.93
Rot. Bonds1

About 6-(3,5-dimethylpyrazol-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine

6-(3,5-dimethylpyrazol-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine (PubChem CID 702232) has the molecular formula C10H10N6 and a molecular weight of 214.23 g/mol. Its IUPAC name is 6-(3,5-dimethylpyrazol-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine.

Molecular Properties

Compound Name6-(3,5-dimethylpyrazol-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine
PubChem CID702232
Molecular FormulaC10H10N6
Molecular Weight214.23 g/mol
Exact Mass214.10
IUPAC Name6-(3,5-dimethylpyrazol-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine
SMILESCc1cc(C)n(-c2ccc3nncn3n2)n1
InChIInChI=1S/C10H10N6/c1-7-5-8(2)16(13-7)10-4-3-9-12-11-6-15(9)14-10/h3-6H,1-2H3
InChIKeyAUQGWZJKGUSFFL-UHFFFAOYSA-N
XLogP0.93
TPSA60.90 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.23
LogP ≤ 50.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

5,7-Dimethyl(1,2,4)triazolo(1,5-a)pyrimidine
CID 24356
Pyrazolo(1,5-a)pyrimidine, 5,7-dimethyl-
CID 215186
6-(3,5-Dimethylpyrazol-1-yl)-3-methyl-[1,2,4]triazolo[4,3-b]pyridazine
CID 909959
6-(3,5-Dimethyl-1H-pyrazol-1-yl)-3-methyl-1,2,4-triazolo[4,3-b][1,2,5,6]tetrazine
CID 578661
5-[2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)ethyl]-N,N,1-trimethyl-1,2,4-triazol-3-amine
CID 165415449
5-[(E)-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)ethenyl]-N,N,1-trimethyl-1,2,4-triazol-3-amine
CID 165415452
4,6-Bis(3,5-dimethyl-1H-pyrazole-1-yl)pyrimidine
CID 762995
6-(3,5-Dimethylpyrazol-1-yl)-3-ethyl-[1,2,4]triazolo[4,3-b][1,2,4,5]tetrazine
CID 134155477
6-(3,5-Dimethyl-1H-pyrazol-1-yl)-1,2,4-triazolo[4,3-b][1,2,4,5]tetrazine
CID 578632
2-[(E)-2-(2-ethyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)ethenyl]-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine
CID 72704320
2-[(E)-2-(5-bromo-2-methyl-1,2,4-triazol-3-yl)ethenyl]-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine
CID 90025485
6-Pyrrolidin-1-yl-[1,2,4]triazolo[4,3-b]pyridazine
CID 647722

Frequently Asked Questions

What is the IUPAC name of 6-(3,5-dimethylpyrazol-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine?
The IUPAC name of 6-(3,5-dimethylpyrazol-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine (CID 702232) is 6-(3,5-dimethylpyrazol-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine.
What is the SMILES notation for 6-(3,5-dimethylpyrazol-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine?
The canonical SMILES for 6-(3,5-dimethylpyrazol-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine is Cc1cc(C)n(-c2ccc3nncn3n2)n1.
What is the InChIKey of 6-(3,5-dimethylpyrazol-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine?
The InChIKey is AUQGWZJKGUSFFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N6/c1-7-5-8(2)16(13-7)10-4-3-9-12-11-6-15(9)14-10/h3-6H,1-2H3.
What are the key properties of 6-(3,5-dimethylpyrazol-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine?
6-(3,5-dimethylpyrazol-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine has a molecular weight of 214.23 g/mol, XLogP of 0.93, 1 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,5-dimethylpyrazol-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine is sourced from PubChem (CID 702232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).