[(2Z,4E)-hexa-2,4-dien-2-yl]diazene

C6H10N2 — CID 87525730

IUPAC[(2Z,4E)-hexa-2,4-dien-2-yl]diazene
SMILES[H]/N=N/C(C)=C\C=C\C
InChIInChI=1S/C6H10N2/c1-3-4-5-6(2)8-7/h3-5,7H,1-2H3/b4-3+,6-5-,8-7+
InChIKeyDXWPYGCXYMADRF-GFCVGDSUSA-N
MW110.16 g/mol
LogP2.50
Rot. Bonds2

About [(2Z,4E)-hexa-2,4-dien-2-yl]diazene

[(2Z,4E)-hexa-2,4-dien-2-yl]diazene (PubChem CID 87525730) has the molecular formula C6H10N2 and a molecular weight of 110.16 g/mol. Its IUPAC name is [(2Z,4E)-hexa-2,4-dien-2-yl]diazene.

Molecular Properties

Compound Name[(2Z,4E)-hexa-2,4-dien-2-yl]diazene
PubChem CID87525730
Molecular FormulaC6H10N2
Molecular Weight110.16 g/mol
Exact Mass110.08
IUPAC Name[(2Z,4E)-hexa-2,4-dien-2-yl]diazene
SMILES[H]/N=N/C(C)=C\C=C\C
InChIInChI=1S/C6H10N2/c1-3-4-5-6(2)8-7/h3-5,7H,1-2H3/b4-3+,6-5-,8-7+
InChIKeyDXWPYGCXYMADRF-GFCVGDSUSA-N
XLogP2.50
TPSA36.21 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.16
LogP ≤ 52.50
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': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(2Z,4E)-hexa-2,4-dien-2-yl]diazene?
The IUPAC name of [(2Z,4E)-hexa-2,4-dien-2-yl]diazene (CID 87525730) is [(2Z,4E)-hexa-2,4-dien-2-yl]diazene.
What is the SMILES notation for [(2Z,4E)-hexa-2,4-dien-2-yl]diazene?
The canonical SMILES for [(2Z,4E)-hexa-2,4-dien-2-yl]diazene is [H]/N=N/C(C)=C\C=C\C.
What is the InChIKey of [(2Z,4E)-hexa-2,4-dien-2-yl]diazene?
The InChIKey is DXWPYGCXYMADRF-GFCVGDSUSA-N. The full InChI is InChI=1S/C6H10N2/c1-3-4-5-6(2)8-7/h3-5,7H,1-2H3/b4-3+,6-5-,8-7+.
What are the key properties of [(2Z,4E)-hexa-2,4-dien-2-yl]diazene?
[(2Z,4E)-hexa-2,4-dien-2-yl]diazene has a molecular weight of 110.16 g/mol, XLogP of 2.50, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2Z,4E)-hexa-2,4-dien-2-yl]diazene is sourced from PubChem (CID 87525730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).