About propan-2-yl-[2-[2-(propan-2-yldiazenyl)propan-2-yloxy]propan-2-yl]diazene
propan-2-yl-[2-[2-(propan-2-yldiazenyl)propan-2-yloxy]propan-2-yl]diazene (PubChem CID 152749266) has the molecular formula C12H26N4O
and a molecular weight of 242.37 g/mol. Its IUPAC name is propan-2-yl-[2-[2-(propan-2-yldiazenyl)propan-2-yloxy]propan-2-yl]diazene.
Molecular Properties
| Compound Name | propan-2-yl-[2-[2-(propan-2-yldiazenyl)propan-2-yloxy]propan-2-yl]diazene |
| PubChem CID | 152749266 |
| Molecular Formula | C12H26N4O |
| Molecular Weight | 242.37 g/mol |
| Exact Mass | 242.21 |
| IUPAC Name | propan-2-yl-[2-[2-(propan-2-yldiazenyl)propan-2-yloxy]propan-2-yl]diazene |
| SMILES | CC(C)/N=N/C(C)(C)OC(C)(C)/N=N/C(C)C |
| InChI | InChI=1S/C12H26N4O/c1-9(2)13-15-11(5,6)17-12(7,8)16-14-10(3)4/h9-10H,1-8H3/b15-13+,16-14+ |
| InChIKey | OVEFKZUECOXXMU-WXUKJITCSA-N |
| XLogP | 4.20 |
| TPSA | 58.67 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 242.37 |
| LogP ≤ 5 | 4.20 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 5 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'} |
|---|
Analyze propan-2-yl-[2-[2-(propan-2-yldiazenyl)propan-2-yloxy]propan-2-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 propan-2-yl-[2-[2-(propan-2-yldiazenyl)propan-2-yloxy]propan-2-yl]diazene?
The IUPAC name of propan-2-yl-[2-[2-(propan-2-yldiazenyl)propan-2-yloxy]propan-2-yl]diazene (CID 152749266) is propan-2-yl-[2-[2-(propan-2-yldiazenyl)propan-2-yloxy]propan-2-yl]diazene.
What is the SMILES notation for propan-2-yl-[2-[2-(propan-2-yldiazenyl)propan-2-yloxy]propan-2-yl]diazene?
The canonical SMILES for propan-2-yl-[2-[2-(propan-2-yldiazenyl)propan-2-yloxy]propan-2-yl]diazene is CC(C)/N=N/C(C)(C)OC(C)(C)/N=N/C(C)C.
What is the InChIKey of propan-2-yl-[2-[2-(propan-2-yldiazenyl)propan-2-yloxy]propan-2-yl]diazene?
The InChIKey is OVEFKZUECOXXMU-WXUKJITCSA-N. The full InChI is InChI=1S/C12H26N4O/c1-9(2)13-15-11(5,6)17-12(7,8)16-14-10(3)4/h9-10H,1-8H3/b15-13+,16-14+.
What are the key properties of propan-2-yl-[2-[2-(propan-2-yldiazenyl)propan-2-yloxy]propan-2-yl]diazene?
propan-2-yl-[2-[2-(propan-2-yldiazenyl)propan-2-yloxy]propan-2-yl]diazene has a molecular weight of 242.37 g/mol, XLogP of 4.20, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-yl-[2-[2-(propan-2-yldiazenyl)propan-2-yloxy]propan-2-yl]diazene is sourced from PubChem (CID 152749266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).