azido(dodecyl)diazene

C12H25N5 — CID 88557126

IUPACazido(dodecyl)diazene
SMILESCCCCCCCCCCCC/N=N/N=[N+]=[N-]
InChIInChI=1S/C12H25N5/c1-2-3-4-5-6-7-8-9-10-11-12-14-16-17-15-13/h2-12H2,1H3/b16-14+
InChIKeyUWNNBLKJSNRTLZ-JQIJEIRASA-N
MW239.37 g/mol
LogP5.58
Rot. Bonds12

About azido(dodecyl)diazene

azido(dodecyl)diazene (PubChem CID 88557126) has the molecular formula C12H25N5 and a molecular weight of 239.37 g/mol. Its IUPAC name is azido(dodecyl)diazene.

Molecular Properties

Compound Nameazido(dodecyl)diazene
PubChem CID88557126
Molecular FormulaC12H25N5
Molecular Weight239.37 g/mol
Exact Mass239.21
IUPAC Nameazido(dodecyl)diazene
SMILESCCCCCCCCCCCC/N=N/N=[N+]=[N-]
InChIInChI=1S/C12H25N5/c1-2-3-4-5-6-7-8-9-10-11-12-14-16-17-15-13/h2-12H2,1H3/b16-14+
InChIKeyUWNNBLKJSNRTLZ-JQIJEIRASA-N
XLogP5.58
TPSA73.48 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500239.37
LogP ≤ 55.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-azidotriacontane
CID 71752669
1-azidohexadecane
CID 11230945
1-azidooctane;hydrochloride
CID 175871639
1-azidobutane
CID 4563922
1-azido-12-[2-[2-[2-[2-(2-decoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]dodecane
CID 171471401
1-azido-2,2-bis(azidomethyl)dodecane
CID 90720911
CID 161246447
CID 161246447
triacontane
CID 12535
dictane
CID 19848341
dohexacontane
CID 522644
hexacosane;octacosane
CID 158944700
bis(decane);hexane
CID 158666782

Frequently Asked Questions

What is the IUPAC name of azido(dodecyl)diazene?
The IUPAC name of azido(dodecyl)diazene (CID 88557126) is azido(dodecyl)diazene.
What is the SMILES notation for azido(dodecyl)diazene?
The canonical SMILES for azido(dodecyl)diazene is CCCCCCCCCCCC/N=N/N=[N+]=[N-].
What is the InChIKey of azido(dodecyl)diazene?
The InChIKey is UWNNBLKJSNRTLZ-JQIJEIRASA-N. The full InChI is InChI=1S/C12H25N5/c1-2-3-4-5-6-7-8-9-10-11-12-14-16-17-15-13/h2-12H2,1H3/b16-14+.
What are the key properties of azido(dodecyl)diazene?
azido(dodecyl)diazene has a molecular weight of 239.37 g/mol, XLogP of 5.58, 12 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for azido(dodecyl)diazene is sourced from PubChem (CID 88557126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).