bis(2-methoxybutan-2-yl)diazene

C10H22N2O2 — CID 54130241

IUPACbis(2-methoxybutan-2-yl)diazene
SMILESCCC(C)(N=NC(C)(CC)OC)OC
InChIInChI=1S/C10H22N2O2/c1-7-9(3,13-5)11-12-10(4,8-2)14-6/h7-8H2,1-6H3
InChIKeyNTVJYBDRRPHZFW-UHFFFAOYSA-N
MW202.30 g/mol
LogP2.98
Rot. Bonds6

About bis(2-methoxybutan-2-yl)diazene

bis(2-methoxybutan-2-yl)diazene (PubChem CID 54130241) has the molecular formula C10H22N2O2 and a molecular weight of 202.30 g/mol. Its IUPAC name is bis(2-methoxybutan-2-yl)diazene.

Molecular Properties

Compound Namebis(2-methoxybutan-2-yl)diazene
PubChem CID54130241
Molecular FormulaC10H22N2O2
Molecular Weight202.30 g/mol
Exact Mass202.17
IUPAC Namebis(2-methoxybutan-2-yl)diazene
SMILESCCC(C)(N=NC(C)(CC)OC)OC
InChIInChI=1S/C10H22N2O2/c1-7-9(3,13-5)11-12-10(4,8-2)14-6/h7-8H2,1-6H3
InChIKeyNTVJYBDRRPHZFW-UHFFFAOYSA-N
XLogP2.98
TPSA43.18 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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 bis(2-methoxybutan-2-yl)diazene?
The IUPAC name of bis(2-methoxybutan-2-yl)diazene (CID 54130241) is bis(2-methoxybutan-2-yl)diazene.
What is the SMILES notation for bis(2-methoxybutan-2-yl)diazene?
The canonical SMILES for bis(2-methoxybutan-2-yl)diazene is CCC(C)(N=NC(C)(CC)OC)OC.
What is the InChIKey of bis(2-methoxybutan-2-yl)diazene?
The InChIKey is NTVJYBDRRPHZFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2/c1-7-9(3,13-5)11-12-10(4,8-2)14-6/h7-8H2,1-6H3.
What are the key properties of bis(2-methoxybutan-2-yl)diazene?
bis(2-methoxybutan-2-yl)diazene has a molecular weight of 202.30 g/mol, XLogP of 2.98, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-methoxybutan-2-yl)diazene is sourced from PubChem (CID 54130241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).