[(3E,5Z,6Z)-5-but-3-en-2-ylidenenona-1,3,6,8-tetraen-4-yl]-[(3E,5Z)-hepta-1,3,5-trien-4-yl]diazene

C20H24N2 — CID 138723760

IUPAC[(3E,5Z,6Z)-5-but-3-en-2-ylidenenona-1,3,6,8-tetraen-4-yl]-[(3E,5Z)-hepta-1,3,5-trien-4-yl]diazene
SMILESC=C/C=C\C(=C(/C)C=C)C(=C/C=C)\N=N\C(\C=C/C)=C\C=C
InChIInChI=1S/C20H24N2/c1-7-12-16-19(17(6)11-5)20(15-10-4)22-21-18(13-8-2)14-9-3/h7-16H,1-2,4-5H2,3,6H3/b14-9-,16-12-,18-13+,19-17-,20-15+,22-21+
InChIKeyHHMQPUISBCLAEZ-QRHOFFQOSA-N
MW292.43 g/mol
LogP6.40
Rot. Bonds9

About [(3E,5Z,6Z)-5-but-3-en-2-ylidenenona-1,3,6,8-tetraen-4-yl]-[(3E,5Z)-hepta-1,3,5-trien-4-yl]diazene

[(3E,5Z,6Z)-5-but-3-en-2-ylidenenona-1,3,6,8-tetraen-4-yl]-[(3E,5Z)-hepta-1,3,5-trien-4-yl]diazene (PubChem CID 138723760) has the molecular formula C20H24N2 and a molecular weight of 292.43 g/mol. Its IUPAC name is [(3E,5Z,6Z)-5-but-3-en-2-ylidenenona-1,3,6,8-tetraen-4-yl]-[(3E,5Z)-hepta-1,3,5-trien-4-yl]diazene.

Molecular Properties

Compound Name[(3E,5Z,6Z)-5-but-3-en-2-ylidenenona-1,3,6,8-tetraen-4-yl]-[(3E,5Z)-hepta-1,3,5-trien-4-yl]diazene
PubChem CID138723760
Molecular FormulaC20H24N2
Molecular Weight292.43 g/mol
Exact Mass292.19
IUPAC Name[(3E,5Z,6Z)-5-but-3-en-2-ylidenenona-1,3,6,8-tetraen-4-yl]-[(3E,5Z)-hepta-1,3,5-trien-4-yl]diazene
SMILESC=C/C=C\C(=C(/C)C=C)C(=C/C=C)\N=N\C(\C=C/C)=C\C=C
InChIInChI=1S/C20H24N2/c1-7-12-16-19(17(6)11-5)20(15-10-4)22-21-18(13-8-2)14-9-3/h7-16H,1-2,4-5H2,3,6H3/b14-9-,16-12-,18-13+,19-17-,20-15+,22-21+
InChIKeyHHMQPUISBCLAEZ-QRHOFFQOSA-N
XLogP6.40
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500292.43
LogP ≤ 56.40
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'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

Analyze [(3E,5Z,6Z)-5-but-3-en-2-ylidenenona-1,3,6,8-tetraen-4-yl]-[(3E,5Z)-hepta-1,3,5-trien-4-yl]diazene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [(3E,5Z,6Z)-5-but-3-en-2-ylidenenona-1,3,6,8-tetraen-4-yl]-[(3E,5Z)-hepta-1,3,5-trien-4-yl]diazene?
The IUPAC name of [(3E,5Z,6Z)-5-but-3-en-2-ylidenenona-1,3,6,8-tetraen-4-yl]-[(3E,5Z)-hepta-1,3,5-trien-4-yl]diazene (CID 138723760) is [(3E,5Z,6Z)-5-but-3-en-2-ylidenenona-1,3,6,8-tetraen-4-yl]-[(3E,5Z)-hepta-1,3,5-trien-4-yl]diazene.
What is the SMILES notation for [(3E,5Z,6Z)-5-but-3-en-2-ylidenenona-1,3,6,8-tetraen-4-yl]-[(3E,5Z)-hepta-1,3,5-trien-4-yl]diazene?
The canonical SMILES for [(3E,5Z,6Z)-5-but-3-en-2-ylidenenona-1,3,6,8-tetraen-4-yl]-[(3E,5Z)-hepta-1,3,5-trien-4-yl]diazene is C=C/C=C\C(=C(/C)C=C)C(=C/C=C)\N=N\C(\C=C/C)=C\C=C.
What is the InChIKey of [(3E,5Z,6Z)-5-but-3-en-2-ylidenenona-1,3,6,8-tetraen-4-yl]-[(3E,5Z)-hepta-1,3,5-trien-4-yl]diazene?
The InChIKey is HHMQPUISBCLAEZ-QRHOFFQOSA-N. The full InChI is InChI=1S/C20H24N2/c1-7-12-16-19(17(6)11-5)20(15-10-4)22-21-18(13-8-2)14-9-3/h7-16H,1-2,4-5H2,3,6H3/b14-9-,16-12-,18-13+,19-17-,20-15+,22-21+.
What are the key properties of [(3E,5Z,6Z)-5-but-3-en-2-ylidenenona-1,3,6,8-tetraen-4-yl]-[(3E,5Z)-hepta-1,3,5-trien-4-yl]diazene?
[(3E,5Z,6Z)-5-but-3-en-2-ylidenenona-1,3,6,8-tetraen-4-yl]-[(3E,5Z)-hepta-1,3,5-trien-4-yl]diazene has a molecular weight of 292.43 g/mol, XLogP of 6.40, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(3E,5Z,6Z)-5-but-3-en-2-ylidenenona-1,3,6,8-tetraen-4-yl]-[(3E,5Z)-hepta-1,3,5-trien-4-yl]diazene is sourced from PubChem (CID 138723760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).