3-methyl-6-(triazol-2-yl)pyridazine

C7H7N5 — CID 166103192

IUPAC3-methyl-6-(triazol-2-yl)pyridazine
SMILESCc1ccc(-n2nccn2)nn1
InChIInChI=1S/C7H7N5/c1-6-2-3-7(11-10-6)12-8-4-5-9-12/h2-5H,1H3
InChIKeyYWFJBPXFZHCQBE-UHFFFAOYSA-N
MW161.17 g/mol
LogP0.37
Rot. Bonds1

About 3-methyl-6-(triazol-2-yl)pyridazine

3-methyl-6-(triazol-2-yl)pyridazine (PubChem CID 166103192) has the molecular formula C7H7N5 and a molecular weight of 161.17 g/mol. Its IUPAC name is 3-methyl-6-(triazol-2-yl)pyridazine.

Molecular Properties

Compound Name3-methyl-6-(triazol-2-yl)pyridazine
PubChem CID166103192
Molecular FormulaC7H7N5
Molecular Weight161.17 g/mol
Exact Mass161.07
IUPAC Name3-methyl-6-(triazol-2-yl)pyridazine
SMILESCc1ccc(-n2nccn2)nn1
InChIInChI=1S/C7H7N5/c1-6-2-3-7(11-10-6)12-8-4-5-9-12/h2-5H,1H3
InChIKeyYWFJBPXFZHCQBE-UHFFFAOYSA-N
XLogP0.37
TPSA56.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.17
LogP ≤ 50.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-6-(triazol-2-yl)pyridazine?
The IUPAC name of 3-methyl-6-(triazol-2-yl)pyridazine (CID 166103192) is 3-methyl-6-(triazol-2-yl)pyridazine.
What is the SMILES notation for 3-methyl-6-(triazol-2-yl)pyridazine?
The canonical SMILES for 3-methyl-6-(triazol-2-yl)pyridazine is Cc1ccc(-n2nccn2)nn1.
What is the InChIKey of 3-methyl-6-(triazol-2-yl)pyridazine?
The InChIKey is YWFJBPXFZHCQBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N5/c1-6-2-3-7(11-10-6)12-8-4-5-9-12/h2-5H,1H3.
What are the key properties of 3-methyl-6-(triazol-2-yl)pyridazine?
3-methyl-6-(triazol-2-yl)pyridazine has a molecular weight of 161.17 g/mol, XLogP of 0.37, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-6-(triazol-2-yl)pyridazine is sourced from PubChem (CID 166103192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).