(7-methoxy-1,2,4-benzotriazin-3-yl)hydrazine

C8H9N5O — CID 2780765

IUPAC(7-methoxy-1,2,4-benzotriazin-3-yl)hydrazine
SMILESCOc1ccc2nc(NN)nnc2c1
InChIInChI=1S/C8H9N5O/c1-14-5-2-3-6-7(4-5)12-13-8(10-6)11-9/h2-4H,9H2,1H3,(H,10,11,13)
InChIKeyOXMIZPFVOATHOH-UHFFFAOYSA-N
MW191.19 g/mol
LogP0.32
Rot. Bonds2

About (7-methoxy-1,2,4-benzotriazin-3-yl)hydrazine

(7-methoxy-1,2,4-benzotriazin-3-yl)hydrazine (PubChem CID 2780765) has the molecular formula C8H9N5O and a molecular weight of 191.19 g/mol. Its IUPAC name is (7-methoxy-1,2,4-benzotriazin-3-yl)hydrazine.

Molecular Properties

Compound Name(7-methoxy-1,2,4-benzotriazin-3-yl)hydrazine
PubChem CID2780765
Molecular FormulaC8H9N5O
Molecular Weight191.19 g/mol
Exact Mass191.08
IUPAC Name(7-methoxy-1,2,4-benzotriazin-3-yl)hydrazine
SMILESCOc1ccc2nc(NN)nnc2c1
InChIInChI=1S/C8H9N5O/c1-14-5-2-3-6-7(4-5)12-13-8(10-6)11-9/h2-4H,9H2,1H3,(H,10,11,13)
InChIKeyOXMIZPFVOATHOH-UHFFFAOYSA-N
XLogP0.32
TPSA85.95 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.19
LogP ≤ 50.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze (7-methoxy-1,2,4-benzotriazin-3-yl)hydrazine 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 (7-methoxy-1,2,4-benzotriazin-3-yl)hydrazine?
The IUPAC name of (7-methoxy-1,2,4-benzotriazin-3-yl)hydrazine (CID 2780765) is (7-methoxy-1,2,4-benzotriazin-3-yl)hydrazine.
What is the SMILES notation for (7-methoxy-1,2,4-benzotriazin-3-yl)hydrazine?
The canonical SMILES for (7-methoxy-1,2,4-benzotriazin-3-yl)hydrazine is COc1ccc2nc(NN)nnc2c1.
What is the InChIKey of (7-methoxy-1,2,4-benzotriazin-3-yl)hydrazine?
The InChIKey is OXMIZPFVOATHOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N5O/c1-14-5-2-3-6-7(4-5)12-13-8(10-6)11-9/h2-4H,9H2,1H3,(H,10,11,13).
What are the key properties of (7-methoxy-1,2,4-benzotriazin-3-yl)hydrazine?
(7-methoxy-1,2,4-benzotriazin-3-yl)hydrazine has a molecular weight of 191.19 g/mol, XLogP of 0.32, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (7-methoxy-1,2,4-benzotriazin-3-yl)hydrazine is sourced from PubChem (CID 2780765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).