methyl(2-methylpropyl)diazene

C5H12N2 — CID 526061

IUPACmethyl(2-methylpropyl)diazene
SMILESC/N=N/CC(C)C
InChIInChI=1S/C5H12N2/c1-5(2)4-7-6-3/h5H,4H2,1-3H3/b7-6+
InChIKeyMNPIONKINHESBM-VOTSOKGWSA-N
MW100.16 g/mol
LogP1.72
Rot. Bonds2

About methyl(2-methylpropyl)diazene

methyl(2-methylpropyl)diazene (PubChem CID 526061) has the molecular formula C5H12N2 and a molecular weight of 100.16 g/mol. Its IUPAC name is methyl(2-methylpropyl)diazene.

Molecular Properties

Compound Namemethyl(2-methylpropyl)diazene
PubChem CID526061
Molecular FormulaC5H12N2
Molecular Weight100.16 g/mol
Exact Mass100.10
IUPAC Namemethyl(2-methylpropyl)diazene
SMILESC/N=N/CC(C)C
InChIInChI=1S/C5H12N2/c1-5(2)4-7-6-3/h5H,4H2,1-3H3/b7-6+
InChIKeyMNPIONKINHESBM-VOTSOKGWSA-N
XLogP1.72
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.16
LogP ≤ 51.72
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'}

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Frequently Asked Questions

What is the IUPAC name of methyl(2-methylpropyl)diazene?
The IUPAC name of methyl(2-methylpropyl)diazene (CID 526061) is methyl(2-methylpropyl)diazene.
What is the SMILES notation for methyl(2-methylpropyl)diazene?
The canonical SMILES for methyl(2-methylpropyl)diazene is C/N=N/CC(C)C.
What is the InChIKey of methyl(2-methylpropyl)diazene?
The InChIKey is MNPIONKINHESBM-VOTSOKGWSA-N. The full InChI is InChI=1S/C5H12N2/c1-5(2)4-7-6-3/h5H,4H2,1-3H3/b7-6+.
What are the key properties of methyl(2-methylpropyl)diazene?
methyl(2-methylpropyl)diazene has a molecular weight of 100.16 g/mol, XLogP of 1.72, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methyl(2-methylpropyl)diazene is sourced from PubChem (CID 526061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).