[(1Z,3Z)-penta-1,3-dienyl]diazene

C₅H₈N₂ — CID 143919321

About [(1Z,3Z)-penta-1,3-dienyl]diazene

[(1Z,3Z)-penta-1,3-dienyl]diazene (PubChem CID 143919321) has the molecular formula C₅H₈N₂ and a molecular weight of 96.13 g/mol. Its IUPAC name is [(1Z,3Z)-penta-1,3-dienyl]diazene.

Molecular Properties

• Compound Name: [(1Z,3Z)-penta-1,3-dienyl]diazene
• PubChem CID: 143919321
• Molecular Formula: C₅H₈N₂
• Molecular Weight: 96.13 g/mol
• Exact Mass: 96.07
• IUPAC Name: [(1Z,3Z)-penta-1,3-dienyl]diazene
• SMILES: [H]/N=N/C=C\C=C/C
• InChI: InChI=1S/C5H8N2/c1-2-3-4-5-7-6/h2-6H,1H3/b3-2-,5-4-,7-6+
• InChIKey: BTXYPLCNILJBCV-MUVPYGFYSA-N
• XLogP: 2.11
• TPSA: 36.21 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 2
• Rotatable Bonds: 2
• Heavy Atoms: 7
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	96.13
LogP ≤ 5	2.11
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of [(1Z,3Z)-penta-1,3-dienyl]diazene?

The IUPAC name of [(1Z,3Z)-penta-1,3-dienyl]diazene (CID 143919321) is [(1Z,3Z)-penta-1,3-dienyl]diazene.

What is the SMILES notation for [(1Z,3Z)-penta-1,3-dienyl]diazene?

The canonical SMILES for [(1Z,3Z)-penta-1,3-dienyl]diazene is [H]/N=N/C=C\C=C/C.

What is the InChIKey of [(1Z,3Z)-penta-1,3-dienyl]diazene?

The InChIKey is BTXYPLCNILJBCV-MUVPYGFYSA-N. The full InChI is InChI=1S/C5H8N2/c1-2-3-4-5-7-6/h2-6H,1H3/b3-2-,5-4-,7-6+.

What are the key properties of [(1Z,3Z)-penta-1,3-dienyl]diazene?

[(1Z,3Z)-penta-1,3-dienyl]diazene has a molecular weight of 96.13 g/mol, XLogP of 2.11, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for [(1Z,3Z)-penta-1,3-dienyl]diazene is sourced from PubChem (CID 143919321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 143919321 — identifiers, structure, computed properties (public domain)

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