ethane;[(2E,4Z)-hexa-2,4-dien-3-yl]-(4-methylcyclohexa-1,3-dien-1-yl)diazene

C15H24N2 — CID 145441524

IUPACethane;[(2E,4Z)-hexa-2,4-dien-3-yl]-(4-methylcyclohexa-1,3-dien-1-yl)diazene
SMILESC/C=C\C(=C/C)\N=N\C1=CC=C(C)CC1.CC
InChIInChI=1S/C13H18N2.C2H6/c1-4-6-12(5-2)14-15-13-9-7-11(3)8-10-13;1-2/h4-7,9H,8,10H2,1-3H3;1-2H3/b6-4-,12-5+,15-14+;
InChIKeyCBZGGPAUZXXUSG-MEGNDXAZSA-N
MW232.37 g/mol
LogP5.57
Rot. Bonds3

About ethane;[(2E,4Z)-hexa-2,4-dien-3-yl]-(4-methylcyclohexa-1,3-dien-1-yl)diazene

ethane;[(2E,4Z)-hexa-2,4-dien-3-yl]-(4-methylcyclohexa-1,3-dien-1-yl)diazene (PubChem CID 145441524) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is ethane;[(2E,4Z)-hexa-2,4-dien-3-yl]-(4-methylcyclohexa-1,3-dien-1-yl)diazene.

Molecular Properties

Compound Nameethane;[(2E,4Z)-hexa-2,4-dien-3-yl]-(4-methylcyclohexa-1,3-dien-1-yl)diazene
PubChem CID145441524
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Nameethane;[(2E,4Z)-hexa-2,4-dien-3-yl]-(4-methylcyclohexa-1,3-dien-1-yl)diazene
SMILESC/C=C\C(=C/C)\N=N\C1=CC=C(C)CC1.CC
InChIInChI=1S/C13H18N2.C2H6/c1-4-6-12(5-2)14-15-13-9-7-11(3)8-10-13;1-2/h4-7,9H,8,10H2,1-3H3;1-2H3/b6-4-,12-5+,15-14+;
InChIKeyCBZGGPAUZXXUSG-MEGNDXAZSA-N
XLogP5.57
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500232.37
LogP ≤ 55.57
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 ethane;[(2E,4Z)-hexa-2,4-dien-3-yl]-(4-methylcyclohexa-1,3-dien-1-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

Related Compounds

Benzocycloheptadiazepine
CID 129779568
1-(1-Azidoethenyl)cyclohexene
CID 152673295
3-Azido-1-ethylcyclohexa-1,3-diene
CID 57259895
1-Azido-4-methylcyclohexa-1,3-diene
CID 89161581
Cyclohexa-1,5-dien-1-yl(cyclohexen-1-yl)diazene
CID 89429390
3,5-Dimethyl-6,7-dihydrocinnoline
CID 89495239
4-Methyl-5-methylidene-6-prop-2-enylidenecyclohexa-1,3-dien-1-amine
CID 91343422
(4-Ethylcyclohexa-1,3-dien-1-yl)-(4-methylcyclohexa-1,3-dien-1-yl)diazene
CID 91539939
(3-Methylcyclohepta-1,3,6-trien-1-yl)-(6-propylcyclohepta-1,4,6-trien-1-yl)diazene
CID 123430879
5-Ethylideneocta-1,3-diene-3-diazonium
CID 123497453
3-ethenyl-4-(4-ethenyl-2-methylhepta-1,3,5-trien-3-yl)-7-methyl-5H-diazepine
CID 123763687
[(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

Frequently Asked Questions

What is the IUPAC name of ethane;[(2E,4Z)-hexa-2,4-dien-3-yl]-(4-methylcyclohexa-1,3-dien-1-yl)diazene?
The IUPAC name of ethane;[(2E,4Z)-hexa-2,4-dien-3-yl]-(4-methylcyclohexa-1,3-dien-1-yl)diazene (CID 145441524) is ethane;[(2E,4Z)-hexa-2,4-dien-3-yl]-(4-methylcyclohexa-1,3-dien-1-yl)diazene.
What is the SMILES notation for ethane;[(2E,4Z)-hexa-2,4-dien-3-yl]-(4-methylcyclohexa-1,3-dien-1-yl)diazene?
The canonical SMILES for ethane;[(2E,4Z)-hexa-2,4-dien-3-yl]-(4-methylcyclohexa-1,3-dien-1-yl)diazene is C/C=C\C(=C/C)\N=N\C1=CC=C(C)CC1.CC.
What is the InChIKey of ethane;[(2E,4Z)-hexa-2,4-dien-3-yl]-(4-methylcyclohexa-1,3-dien-1-yl)diazene?
The InChIKey is CBZGGPAUZXXUSG-MEGNDXAZSA-N. The full InChI is InChI=1S/C13H18N2.C2H6/c1-4-6-12(5-2)14-15-13-9-7-11(3)8-10-13;1-2/h4-7,9H,8,10H2,1-3H3;1-2H3/b6-4-,12-5+,15-14+;.
What are the key properties of ethane;[(2E,4Z)-hexa-2,4-dien-3-yl]-(4-methylcyclohexa-1,3-dien-1-yl)diazene?
ethane;[(2E,4Z)-hexa-2,4-dien-3-yl]-(4-methylcyclohexa-1,3-dien-1-yl)diazene has a molecular weight of 232.37 g/mol, XLogP of 5.57, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;[(2E,4Z)-hexa-2,4-dien-3-yl]-(4-methylcyclohexa-1,3-dien-1-yl)diazene is sourced from PubChem (CID 145441524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).