1-azidotetrazol-5-amine;zinc

CH2N8Zn — CID 175217844

IUPAC1-azidotetrazol-5-amine;zinc
SMILES[N-]=[N+]=Nn1nnnc1N.[Zn]
InChIInChI=1S/CH2N8.Zn/c2-1-4-6-8-9(1)7-5-3;/h(H2,2,4,8);
InChIKeyRGAXUSYUAGTSTE-UHFFFAOYSA-N
MW191.47 g/mol
LogP-0.67
Rot. Bonds1

About 1-azidotetrazol-5-amine;zinc

1-azidotetrazol-5-amine;zinc (PubChem CID 175217844) has the molecular formula CH2N8Zn and a molecular weight of 191.47 g/mol. Its IUPAC name is 1-azidotetrazol-5-amine;zinc.

Molecular Properties

Compound Name1-azidotetrazol-5-amine;zinc
PubChem CID175217844
Molecular FormulaCH2N8Zn
Molecular Weight191.47 g/mol
Exact Mass189.97
IUPAC Name1-azidotetrazol-5-amine;zinc
SMILES[N-]=[N+]=Nn1nnnc1N.[Zn]
InChIInChI=1S/CH2N8.Zn/c2-1-4-6-8-9(1)7-5-3;/h(H2,2,4,8);
InChIKeyRGAXUSYUAGTSTE-UHFFFAOYSA-N
XLogP-0.67
TPSA118.38 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.47
LogP ≤ 5-0.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-azidotetrazol-5-amine;zinc?
The IUPAC name of 1-azidotetrazol-5-amine;zinc (CID 175217844) is 1-azidotetrazol-5-amine;zinc.
What is the SMILES notation for 1-azidotetrazol-5-amine;zinc?
The canonical SMILES for 1-azidotetrazol-5-amine;zinc is [N-]=[N+]=Nn1nnnc1N.[Zn].
What is the InChIKey of 1-azidotetrazol-5-amine;zinc?
The InChIKey is RGAXUSYUAGTSTE-UHFFFAOYSA-N. The full InChI is InChI=1S/CH2N8.Zn/c2-1-4-6-8-9(1)7-5-3;/h(H2,2,4,8);.
What are the key properties of 1-azidotetrazol-5-amine;zinc?
1-azidotetrazol-5-amine;zinc has a molecular weight of 191.47 g/mol, XLogP of -0.67, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-azidotetrazol-5-amine;zinc is sourced from PubChem (CID 175217844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).