2,3,3a,4,5,6-hexahydro-1H-inden-4-yl(2,3,5,6,7,7a-hexahydro-1H-inden-4-yl)diazene

C18H26N2 — CID 23436662

IUPAC2,3,3a,4,5,6-hexahydro-1H-inden-4-yl(2,3,5,6,7,7a-hexahydro-1H-inden-4-yl)diazene
SMILESC1=C2CCCC2C(/N=N/C2=C3CCCC3CCC2)CC1
InChIInChI=1S/C18H26N2/c1-5-13-7-3-11-17(15(13)9-1)19-20-18-12-4-8-14-6-2-10-16(14)18/h7,14-15,17H,1-6,8-12H2/b20-19+
InChIKeyNITNILMLDIDCPF-FMQUCBEESA-N
MW270.42 g/mol
LogP5.57
Rot. Bonds2

About 2,3,3a,4,5,6-hexahydro-1H-inden-4-yl(2,3,5,6,7,7a-hexahydro-1H-inden-4-yl)diazene

2,3,3a,4,5,6-hexahydro-1H-inden-4-yl(2,3,5,6,7,7a-hexahydro-1H-inden-4-yl)diazene (PubChem CID 23436662) has the molecular formula C18H26N2 and a molecular weight of 270.42 g/mol. Its IUPAC name is 2,3,3a,4,5,6-hexahydro-1H-inden-4-yl(2,3,5,6,7,7a-hexahydro-1H-inden-4-yl)diazene.

Molecular Properties

Compound Name2,3,3a,4,5,6-hexahydro-1H-inden-4-yl(2,3,5,6,7,7a-hexahydro-1H-inden-4-yl)diazene
PubChem CID23436662
Molecular FormulaC18H26N2
Molecular Weight270.42 g/mol
Exact Mass270.21
IUPAC Name2,3,3a,4,5,6-hexahydro-1H-inden-4-yl(2,3,5,6,7,7a-hexahydro-1H-inden-4-yl)diazene
SMILESC1=C2CCCC2C(/N=N/C2=C3CCCC3CCC2)CC1
InChIInChI=1S/C18H26N2/c1-5-13-7-3-11-17(15(13)9-1)19-20-18-12-4-8-14-6-2-10-16(14)18/h7,14-15,17H,1-6,8-12H2/b20-19+
InChIKeyNITNILMLDIDCPF-FMQUCBEESA-N
XLogP5.57
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500270.42
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': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 2,3,3a,4,5,6-hexahydro-1H-inden-4-yl(2,3,5,6,7,7a-hexahydro-1H-inden-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 2,3,3a,4,5,6-hexahydro-1H-inden-4-yl(2,3,5,6,7,7a-hexahydro-1H-inden-4-yl)diazene?
The IUPAC name of 2,3,3a,4,5,6-hexahydro-1H-inden-4-yl(2,3,5,6,7,7a-hexahydro-1H-inden-4-yl)diazene (CID 23436662) is 2,3,3a,4,5,6-hexahydro-1H-inden-4-yl(2,3,5,6,7,7a-hexahydro-1H-inden-4-yl)diazene.
What is the SMILES notation for 2,3,3a,4,5,6-hexahydro-1H-inden-4-yl(2,3,5,6,7,7a-hexahydro-1H-inden-4-yl)diazene?
The canonical SMILES for 2,3,3a,4,5,6-hexahydro-1H-inden-4-yl(2,3,5,6,7,7a-hexahydro-1H-inden-4-yl)diazene is C1=C2CCCC2C(/N=N/C2=C3CCCC3CCC2)CC1.
What is the InChIKey of 2,3,3a,4,5,6-hexahydro-1H-inden-4-yl(2,3,5,6,7,7a-hexahydro-1H-inden-4-yl)diazene?
The InChIKey is NITNILMLDIDCPF-FMQUCBEESA-N. The full InChI is InChI=1S/C18H26N2/c1-5-13-7-3-11-17(15(13)9-1)19-20-18-12-4-8-14-6-2-10-16(14)18/h7,14-15,17H,1-6,8-12H2/b20-19+.
What are the key properties of 2,3,3a,4,5,6-hexahydro-1H-inden-4-yl(2,3,5,6,7,7a-hexahydro-1H-inden-4-yl)diazene?
2,3,3a,4,5,6-hexahydro-1H-inden-4-yl(2,3,5,6,7,7a-hexahydro-1H-inden-4-yl)diazene has a molecular weight of 270.42 g/mol, XLogP of 5.57, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,3a,4,5,6-hexahydro-1H-inden-4-yl(2,3,5,6,7,7a-hexahydro-1H-inden-4-yl)diazene is sourced from PubChem (CID 23436662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).