(7-methyl-2H-triazolo[4,5-d]pyridazin-4-yl)hydrazine

C5H7N7 — CID 596646

IUPAC(7-methyl-2H-triazolo[4,5-d]pyridazin-4-yl)hydrazine
SMILESCc1nnc(NN)c2n[nH]nc12
InChIInChI=1S/C5H7N7/c1-2-3-4(10-12-9-3)5(7-6)11-8-2/h6H2,1H3,(H,7,11)(H,9,10,12)
InChIKeyFMCUTTGESGNIEE-UHFFFAOYSA-N
MW165.16 g/mol
LogP-0.66
Rot. Bonds1

About (7-methyl-2H-triazolo[4,5-d]pyridazin-4-yl)hydrazine

(7-methyl-2H-triazolo[4,5-d]pyridazin-4-yl)hydrazine (PubChem CID 596646) has the molecular formula C5H7N7 and a molecular weight of 165.16 g/mol. Its IUPAC name is (7-methyl-2H-triazolo[4,5-d]pyridazin-4-yl)hydrazine.

Molecular Properties

Compound Name(7-methyl-2H-triazolo[4,5-d]pyridazin-4-yl)hydrazine
PubChem CID596646
Molecular FormulaC5H7N7
Molecular Weight165.16 g/mol
Exact Mass165.08
IUPAC Name(7-methyl-2H-triazolo[4,5-d]pyridazin-4-yl)hydrazine
SMILESCc1nnc(NN)c2n[nH]nc12
InChIInChI=1S/C5H7N7/c1-2-3-4(10-12-9-3)5(7-6)11-8-2/h6H2,1H3,(H,7,11)(H,9,10,12)
InChIKeyFMCUTTGESGNIEE-UHFFFAOYSA-N
XLogP-0.66
TPSA105.40 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.16
LogP ≤ 5-0.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (7-methyl-2H-triazolo[4,5-d]pyridazin-4-yl)hydrazine?
The IUPAC name of (7-methyl-2H-triazolo[4,5-d]pyridazin-4-yl)hydrazine (CID 596646) is (7-methyl-2H-triazolo[4,5-d]pyridazin-4-yl)hydrazine.
What is the SMILES notation for (7-methyl-2H-triazolo[4,5-d]pyridazin-4-yl)hydrazine?
The canonical SMILES for (7-methyl-2H-triazolo[4,5-d]pyridazin-4-yl)hydrazine is Cc1nnc(NN)c2n[nH]nc12.
What is the InChIKey of (7-methyl-2H-triazolo[4,5-d]pyridazin-4-yl)hydrazine?
The InChIKey is FMCUTTGESGNIEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N7/c1-2-3-4(10-12-9-3)5(7-6)11-8-2/h6H2,1H3,(H,7,11)(H,9,10,12).
What are the key properties of (7-methyl-2H-triazolo[4,5-d]pyridazin-4-yl)hydrazine?
(7-methyl-2H-triazolo[4,5-d]pyridazin-4-yl)hydrazine has a molecular weight of 165.16 g/mol, XLogP of -0.66, 1 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (7-methyl-2H-triazolo[4,5-d]pyridazin-4-yl)hydrazine is sourced from PubChem (CID 596646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).