(5-methyl-1H-1,2,4-triazol-3-yl)hydrazine

C3H7N5 — CID 4319388

IUPAC(5-methyl-1H-1,2,4-triazol-3-yl)hydrazine
SMILESCc1nc(NN)n[nH]1
InChIInChI=1S/C3H7N5/c1-2-5-3(6-4)8-7-2/h4H2,1H3,(H2,5,6,7,8)
InChIKeyOLCWHQOQAGJSLA-UHFFFAOYSA-N
MW113.12 g/mol
LogP-0.60
Rot. Bonds1

About (5-methyl-1H-1,2,4-triazol-3-yl)hydrazine

(5-methyl-1H-1,2,4-triazol-3-yl)hydrazine (PubChem CID 4319388) has the molecular formula C3H7N5 and a molecular weight of 113.12 g/mol. Its IUPAC name is (5-methyl-1H-1,2,4-triazol-3-yl)hydrazine.

Molecular Properties

Compound Name(5-methyl-1H-1,2,4-triazol-3-yl)hydrazine
PubChem CID4319388
Molecular FormulaC3H7N5
Molecular Weight113.12 g/mol
Exact Mass113.07
IUPAC Name(5-methyl-1H-1,2,4-triazol-3-yl)hydrazine
SMILESCc1nc(NN)n[nH]1
InChIInChI=1S/C3H7N5/c1-2-5-3(6-4)8-7-2/h4H2,1H3,(H2,5,6,7,8)
InChIKeyOLCWHQOQAGJSLA-UHFFFAOYSA-N
XLogP-0.60
TPSA79.62 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.12
LogP ≤ 5-0.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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 (5-methyl-1H-1,2,4-triazol-3-yl)hydrazine?
The IUPAC name of (5-methyl-1H-1,2,4-triazol-3-yl)hydrazine (CID 4319388) is (5-methyl-1H-1,2,4-triazol-3-yl)hydrazine.
What is the SMILES notation for (5-methyl-1H-1,2,4-triazol-3-yl)hydrazine?
The canonical SMILES for (5-methyl-1H-1,2,4-triazol-3-yl)hydrazine is Cc1nc(NN)n[nH]1.
What is the InChIKey of (5-methyl-1H-1,2,4-triazol-3-yl)hydrazine?
The InChIKey is OLCWHQOQAGJSLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7N5/c1-2-5-3(6-4)8-7-2/h4H2,1H3,(H2,5,6,7,8).
What are the key properties of (5-methyl-1H-1,2,4-triazol-3-yl)hydrazine?
(5-methyl-1H-1,2,4-triazol-3-yl)hydrazine has a molecular weight of 113.12 g/mol, XLogP of -0.60, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methyl-1H-1,2,4-triazol-3-yl)hydrazine is sourced from PubChem (CID 4319388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).