About 2-azanidylethylazanide;cobalt(2+);tetranitrite
2-azanidylethylazanide;cobalt(2+);tetranitrite (PubChem CID 50912473) has the molecular formula C2H6CoN6O8-4
and a molecular weight of 301.04 g/mol. Its IUPAC name is 2-azanidylethylazanide;cobalt(2+);tetranitrite.
Molecular Properties
| Compound Name | 2-azanidylethylazanide;cobalt(2+);tetranitrite |
| PubChem CID | 50912473 |
| Molecular Formula | C2H6CoN6O8-4 |
| Molecular Weight | 301.04 g/mol |
| Exact Mass | 300.96 |
| IUPAC Name | 2-azanidylethylazanide;cobalt(2+);tetranitrite |
| SMILES | O=N[O-].O=N[O-].O=N[O-].O=N[O-].[Co+2].[NH-]CC[NH-] |
| InChI | InChI=1S/C2H6N2.Co.4HNO2/c3-1-2-4;;4*2-1-3/h3-4H,1-2H2;;4*(H,2,3)/q-2;+2;;;;/p-4 |
| InChIKey | AUHOAMGMYNBVIA-UHFFFAOYSA-J |
| XLogP | 2.09 |
| TPSA | 257.56 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 12 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 301.04 |
| LogP ≤ 5 | 2.09 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 12 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'N_oxide', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
|---|
Analyze 2-azanidylethylazanide;cobalt(2+);tetranitrite with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of 2-azanidylethylazanide;cobalt(2+);tetranitrite?
The IUPAC name of 2-azanidylethylazanide;cobalt(2+);tetranitrite (CID 50912473) is 2-azanidylethylazanide;cobalt(2+);tetranitrite.
What is the SMILES notation for 2-azanidylethylazanide;cobalt(2+);tetranitrite?
The canonical SMILES for 2-azanidylethylazanide;cobalt(2+);tetranitrite is O=N[O-].O=N[O-].O=N[O-].O=N[O-].[Co+2].[NH-]CC[NH-].
What is the InChIKey of 2-azanidylethylazanide;cobalt(2+);tetranitrite?
The InChIKey is AUHOAMGMYNBVIA-UHFFFAOYSA-J. The full InChI is InChI=1S/C2H6N2.Co.4HNO2/c3-1-2-4;;4*2-1-3/h3-4H,1-2H2;;4*(H,2,3)/q-2;+2;;;;/p-4.
What are the key properties of 2-azanidylethylazanide;cobalt(2+);tetranitrite?
2-azanidylethylazanide;cobalt(2+);tetranitrite has a molecular weight of 301.04 g/mol, XLogP of 2.09, 1 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 2-azanidylethylazanide;cobalt(2+);tetranitrite is sourced from PubChem (CID 50912473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).