diazenyl(propyl)diazene

C3H8N4 — CID 118680673

IUPACdiazenyl(propyl)diazene
SMILES[H]/N=N/N=N/CCC
InChIInChI=1S/C3H8N4/c1-2-3-5-7-6-4/h4H,2-3H2,1H3/b6-4+,7-5+
InChIKeyYATNFBHLZWNHCX-YDFGWWAZSA-N
MW100.12 g/mol
LogP1.79
Rot. Bonds3

About diazenyl(propyl)diazene

diazenyl(propyl)diazene (PubChem CID 118680673) has the molecular formula C3H8N4 and a molecular weight of 100.12 g/mol. Its IUPAC name is diazenyl(propyl)diazene.

Molecular Properties

Compound Namediazenyl(propyl)diazene
PubChem CID118680673
Molecular FormulaC3H8N4
Molecular Weight100.12 g/mol
Exact Mass100.07
IUPAC Namediazenyl(propyl)diazene
SMILES[H]/N=N/N=N/CCC
InChIInChI=1S/C3H8N4/c1-2-3-5-7-6-4/h4H,2-3H2,1H3/b6-4+,7-5+
InChIKeyYATNFBHLZWNHCX-YDFGWWAZSA-N
XLogP1.79
TPSA60.93 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.12
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', '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 diazenyl(propyl)diazene?
The IUPAC name of diazenyl(propyl)diazene (CID 118680673) is diazenyl(propyl)diazene.
What is the SMILES notation for diazenyl(propyl)diazene?
The canonical SMILES for diazenyl(propyl)diazene is [H]/N=N/N=N/CCC.
What is the InChIKey of diazenyl(propyl)diazene?
The InChIKey is YATNFBHLZWNHCX-YDFGWWAZSA-N. The full InChI is InChI=1S/C3H8N4/c1-2-3-5-7-6-4/h4H,2-3H2,1H3/b6-4+,7-5+.
What are the key properties of diazenyl(propyl)diazene?
diazenyl(propyl)diazene has a molecular weight of 100.12 g/mol, XLogP of 1.79, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diazenyl(propyl)diazene is sourced from PubChem (CID 118680673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).