ethenyl(prop-1-enyl)diazene

C5H8N2 — CID 59992633

IUPACethenyl(prop-1-enyl)diazene
SMILESC=C/N=N/C=CC
InChIInChI=1S/C5H8N2/c1-3-5-7-6-4-2/h3-5H,2H2,1H3/b5-3?,7-6+
InChIKeyFNFLKTWIKBPJPJ-BDEHTBJLSA-N
MW96.13 g/mol
LogP2.12
Rot. Bonds2

About ethenyl(prop-1-enyl)diazene

ethenyl(prop-1-enyl)diazene (PubChem CID 59992633) has the molecular formula C5H8N2 and a molecular weight of 96.13 g/mol. Its IUPAC name is ethenyl(prop-1-enyl)diazene.

Molecular Properties

Compound Nameethenyl(prop-1-enyl)diazene
PubChem CID59992633
Molecular FormulaC5H8N2
Molecular Weight96.13 g/mol
Exact Mass96.07
IUPAC Nameethenyl(prop-1-enyl)diazene
SMILESC=C/N=N/C=CC
InChIInChI=1S/C5H8N2/c1-3-5-7-6-4-2/h3-5H,2H2,1H3/b5-3?,7-6+
InChIKeyFNFLKTWIKBPJPJ-BDEHTBJLSA-N
XLogP2.12
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50096.13
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of ethenyl(prop-1-enyl)diazene?
The IUPAC name of ethenyl(prop-1-enyl)diazene (CID 59992633) is ethenyl(prop-1-enyl)diazene.
What is the SMILES notation for ethenyl(prop-1-enyl)diazene?
The canonical SMILES for ethenyl(prop-1-enyl)diazene is C=C/N=N/C=CC.
What is the InChIKey of ethenyl(prop-1-enyl)diazene?
The InChIKey is FNFLKTWIKBPJPJ-BDEHTBJLSA-N. The full InChI is InChI=1S/C5H8N2/c1-3-5-7-6-4-2/h3-5H,2H2,1H3/b5-3?,7-6+.
What are the key properties of ethenyl(prop-1-enyl)diazene?
ethenyl(prop-1-enyl)diazene has a molecular weight of 96.13 g/mol, XLogP of 2.12, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethenyl(prop-1-enyl)diazene is sourced from PubChem (CID 59992633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).