propan-2-yl-[2-[2-(propan-2-yldiazenyl)propan-2-yloxy]propan-2-yl]diazene

C12H26N4O — CID 152749266

IUPACpropan-2-yl-[2-[2-(propan-2-yldiazenyl)propan-2-yloxy]propan-2-yl]diazene
SMILESCC(C)/N=N/C(C)(C)OC(C)(C)/N=N/C(C)C
InChIInChI=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+
InChIKeyOVEFKZUECOXXMU-WXUKJITCSA-N
MW242.37 g/mol
LogP4.20
Rot. Bonds6

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 Namepropan-2-yl-[2-[2-(propan-2-yldiazenyl)propan-2-yloxy]propan-2-yl]diazene
PubChem CID152749266
Molecular FormulaC12H26N4O
Molecular Weight242.37 g/mol
Exact Mass242.21
IUPAC Namepropan-2-yl-[2-[2-(propan-2-yldiazenyl)propan-2-yloxy]propan-2-yl]diazene
SMILESCC(C)/N=N/C(C)(C)OC(C)(C)/N=N/C(C)C
InChIInChI=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+
InChIKeyOVEFKZUECOXXMU-WXUKJITCSA-N
XLogP4.20
TPSA58.67 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.37
LogP ≤ 54.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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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).