1,2,5-oxadiazol-3-ylhydrazine

C2H4N4O — CID 70031082

IUPAC1,2,5-oxadiazol-3-ylhydrazine
SMILESNNc1cnon1
InChIInChI=1S/C2H4N4O/c3-5-2-1-4-7-6-2/h1H,3H2,(H,5,6)
InChIKeyCOSXPOLAMXIZMM-UHFFFAOYSA-N
MW100.08 g/mol
LogP-0.64
Rot. Bonds1

About 1,2,5-oxadiazol-3-ylhydrazine

1,2,5-oxadiazol-3-ylhydrazine (PubChem CID 70031082) has the molecular formula C2H4N4O and a molecular weight of 100.08 g/mol. Its IUPAC name is 1,2,5-oxadiazol-3-ylhydrazine.

Molecular Properties

Compound Name1,2,5-oxadiazol-3-ylhydrazine
PubChem CID70031082
Molecular FormulaC2H4N4O
Molecular Weight100.08 g/mol
Exact Mass100.04
IUPAC Name1,2,5-oxadiazol-3-ylhydrazine
SMILESNNc1cnon1
InChIInChI=1S/C2H4N4O/c3-5-2-1-4-7-6-2/h1H,3H2,(H,5,6)
InChIKeyCOSXPOLAMXIZMM-UHFFFAOYSA-N
XLogP-0.64
TPSA76.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.08
LogP ≤ 5-0.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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 1,2,5-oxadiazol-3-ylhydrazine?
The IUPAC name of 1,2,5-oxadiazol-3-ylhydrazine (CID 70031082) is 1,2,5-oxadiazol-3-ylhydrazine.
What is the SMILES notation for 1,2,5-oxadiazol-3-ylhydrazine?
The canonical SMILES for 1,2,5-oxadiazol-3-ylhydrazine is NNc1cnon1.
What is the InChIKey of 1,2,5-oxadiazol-3-ylhydrazine?
The InChIKey is COSXPOLAMXIZMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4N4O/c3-5-2-1-4-7-6-2/h1H,3H2,(H,5,6).
What are the key properties of 1,2,5-oxadiazol-3-ylhydrazine?
1,2,5-oxadiazol-3-ylhydrazine has a molecular weight of 100.08 g/mol, XLogP of -0.64, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,5-oxadiazol-3-ylhydrazine is sourced from PubChem (CID 70031082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).