azidomethyl(methyl)diazene

C2H5N5 — CID 21424256

IUPACazidomethyl(methyl)diazene
SMILESC/N=N/CN=[N+]=[N-]
InChIInChI=1S/C2H5N5/c1-4-5-2-6-7-3/h2H2,1H3/b5-4+
InChIKeyVKSOXTULKQHDFZ-SNAWJCMRSA-N
MW99.10 g/mol
LogP1.34
Rot. Bonds2

About azidomethyl(methyl)diazene

azidomethyl(methyl)diazene (PubChem CID 21424256) has the molecular formula C2H5N5 and a molecular weight of 99.10 g/mol. Its IUPAC name is azidomethyl(methyl)diazene.

Molecular Properties

Compound Nameazidomethyl(methyl)diazene
PubChem CID21424256
Molecular FormulaC2H5N5
Molecular Weight99.10 g/mol
Exact Mass99.05
IUPAC Nameazidomethyl(methyl)diazene
SMILESC/N=N/CN=[N+]=[N-]
InChIInChI=1S/C2H5N5/c1-4-5-2-6-7-3/h2H2,1H3/b5-4+
InChIKeyVKSOXTULKQHDFZ-SNAWJCMRSA-N
XLogP1.34
TPSA73.48 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50099.10
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of azidomethyl(methyl)diazene?
The IUPAC name of azidomethyl(methyl)diazene (CID 21424256) is azidomethyl(methyl)diazene.
What is the SMILES notation for azidomethyl(methyl)diazene?
The canonical SMILES for azidomethyl(methyl)diazene is C/N=N/CN=[N+]=[N-].
What is the InChIKey of azidomethyl(methyl)diazene?
The InChIKey is VKSOXTULKQHDFZ-SNAWJCMRSA-N. The full InChI is InChI=1S/C2H5N5/c1-4-5-2-6-7-3/h2H2,1H3/b5-4+.
What are the key properties of azidomethyl(methyl)diazene?
azidomethyl(methyl)diazene has a molecular weight of 99.10 g/mol, XLogP of 1.34, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for azidomethyl(methyl)diazene is sourced from PubChem (CID 21424256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).