2,3-dimethylbutan-2-yldiazene

C6H14N2 — CID 130441706

IUPAC2,3-dimethylbutan-2-yldiazene
SMILES[H]/N=N/C(C)(C)C(C)C
InChIInChI=1S/C6H14N2/c1-5(2)6(3,4)8-7/h5,7H,1-4H3/b8-7+
InChIKeyXUICDRBXTZTSJX-BQYQJAHWSA-N
MW114.19 g/mol
LogP2.45
Rot. Bonds2

About 2,3-dimethylbutan-2-yldiazene

2,3-dimethylbutan-2-yldiazene (PubChem CID 130441706) has the molecular formula C6H14N2 and a molecular weight of 114.19 g/mol. Its IUPAC name is 2,3-dimethylbutan-2-yldiazene.

Molecular Properties

Compound Name2,3-dimethylbutan-2-yldiazene
PubChem CID130441706
Molecular FormulaC6H14N2
Molecular Weight114.19 g/mol
Exact Mass114.12
IUPAC Name2,3-dimethylbutan-2-yldiazene
SMILES[H]/N=N/C(C)(C)C(C)C
InChIInChI=1S/C6H14N2/c1-5(2)6(3,4)8-7/h5,7H,1-4H3/b8-7+
InChIKeyXUICDRBXTZTSJX-BQYQJAHWSA-N
XLogP2.45
TPSA36.21 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.19
LogP ≤ 52.45
H-Bond Donors ≤ 51
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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Related Compounds

CID 122549987
CID 122549987
3-diazenyl-2,2,3,4,4-pentamethylpentanedinitrile
CID 174779390
2-diazenylpropane-1,2-diol
CID 174859273
2,2-dibromo-3-methylbutane
CID 13047634
CID 123563572
CID 123563572
2-diazenyl-N-methylbutan-2-amine
CID 163770024
N-(2,3-dimethylbutan-2-yl)-3-methylbutan-2-imine
CID 118217255
1-diazenylpropane-1,1-diamine
CID 57165704
azane;2-bromo-2,3-dimethylbutane
CID 131989139
2-bromo-2-methylpropan-1-imine
CID 142134063
1-diazenylethanethiol
CID 173486196
(1-diazenyl-2-methylpropyl)diazene
CID 57086976

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethylbutan-2-yldiazene?
The IUPAC name of 2,3-dimethylbutan-2-yldiazene (CID 130441706) is 2,3-dimethylbutan-2-yldiazene.
What is the SMILES notation for 2,3-dimethylbutan-2-yldiazene?
The canonical SMILES for 2,3-dimethylbutan-2-yldiazene is [H]/N=N/C(C)(C)C(C)C.
What is the InChIKey of 2,3-dimethylbutan-2-yldiazene?
The InChIKey is XUICDRBXTZTSJX-BQYQJAHWSA-N. The full InChI is InChI=1S/C6H14N2/c1-5(2)6(3,4)8-7/h5,7H,1-4H3/b8-7+.
What are the key properties of 2,3-dimethylbutan-2-yldiazene?
2,3-dimethylbutan-2-yldiazene has a molecular weight of 114.19 g/mol, XLogP of 2.45, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethylbutan-2-yldiazene is sourced from PubChem (CID 130441706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).