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

C11H12N6 — CID 909959

IUPAC6-(3,5-dimethylpyrazol-1-yl)-3-methyl-[1,2,4]triazolo[4,3-b]pyridazine
SMILESCc1cc(C)n(-c2ccc3nnc(C)n3n2)n1
InChIInChI=1S/C11H12N6/c1-7-6-8(2)16(14-7)11-5-4-10-13-12-9(3)17(10)15-11/h4-6H,1-3H3
InChIKeyWBEHZOSPCLOZLD-UHFFFAOYSA-N
MW228.26 g/mol
LogP1.24
Rot. Bonds1

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

6-(3,5-dimethylpyrazol-1-yl)-3-methyl-[1,2,4]triazolo[4,3-b]pyridazine (PubChem CID 909959) has the molecular formula C11H12N6 and a molecular weight of 228.26 g/mol. Its IUPAC name is 6-(3,5-dimethylpyrazol-1-yl)-3-methyl-[1,2,4]triazolo[4,3-b]pyridazine.

Molecular Properties

Compound Name6-(3,5-dimethylpyrazol-1-yl)-3-methyl-[1,2,4]triazolo[4,3-b]pyridazine
PubChem CID909959
Molecular FormulaC11H12N6
Molecular Weight228.26 g/mol
Exact Mass228.11
IUPAC Name6-(3,5-dimethylpyrazol-1-yl)-3-methyl-[1,2,4]triazolo[4,3-b]pyridazine
SMILESCc1cc(C)n(-c2ccc3nnc(C)n3n2)n1
InChIInChI=1S/C11H12N6/c1-7-6-8(2)16(14-7)11-5-4-10-13-12-9(3)17(10)15-11/h4-6H,1-3H3
InChIKeyWBEHZOSPCLOZLD-UHFFFAOYSA-N
XLogP1.24
TPSA60.90 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.26
LogP ≤ 51.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-(3,5-dimethylpyrazol-1-yl)-3-methyl-[1,2,4]triazolo[4,3-b]pyridazine?
The IUPAC name of 6-(3,5-dimethylpyrazol-1-yl)-3-methyl-[1,2,4]triazolo[4,3-b]pyridazine (CID 909959) is 6-(3,5-dimethylpyrazol-1-yl)-3-methyl-[1,2,4]triazolo[4,3-b]pyridazine.
What is the SMILES notation for 6-(3,5-dimethylpyrazol-1-yl)-3-methyl-[1,2,4]triazolo[4,3-b]pyridazine?
The canonical SMILES for 6-(3,5-dimethylpyrazol-1-yl)-3-methyl-[1,2,4]triazolo[4,3-b]pyridazine is Cc1cc(C)n(-c2ccc3nnc(C)n3n2)n1.
What is the InChIKey of 6-(3,5-dimethylpyrazol-1-yl)-3-methyl-[1,2,4]triazolo[4,3-b]pyridazine?
The InChIKey is WBEHZOSPCLOZLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N6/c1-7-6-8(2)16(14-7)11-5-4-10-13-12-9(3)17(10)15-11/h4-6H,1-3H3.
What are the key properties of 6-(3,5-dimethylpyrazol-1-yl)-3-methyl-[1,2,4]triazolo[4,3-b]pyridazine?
6-(3,5-dimethylpyrazol-1-yl)-3-methyl-[1,2,4]triazolo[4,3-b]pyridazine has a molecular weight of 228.26 g/mol, XLogP of 1.24, 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)-3-methyl-[1,2,4]triazolo[4,3-b]pyridazine is sourced from PubChem (CID 909959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).