About azidoethane
azidoethane (PubChem CID 59509168) has the molecular formula C2H4N3+
and a molecular weight of 70.07 g/mol. Its IUPAC name is azidoethane.
Molecular Properties
| Compound Name | azidoethane |
|---|
| PubChem CID | 59509168 |
|---|
| Molecular Formula | C2H4N3+ |
|---|
| Molecular Weight | 70.07 g/mol |
|---|
| Exact Mass | 70.04 |
|---|
| IUPAC Name | azidoethane |
|---|
| SMILES | C[CH+]N=[N+]=[N-] |
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| InChI | InChI=1S/C2H4N3/c1-2-4-5-3/h2H,1H3/q+1 |
|---|
| InChIKey | NJORHVBPLDZNDM-UHFFFAOYSA-N |
|---|
| XLogP | 1.48 |
|---|
| TPSA | 48.76 Ų |
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| H-Bond Donors | |
|---|
| H-Bond Acceptors | 1 |
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| Rotatable Bonds | 1 |
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| Heavy Atoms | 5 |
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| Complexity | — |
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Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|
| MW ≤ 500 | 70.07 |
| LogP ≤ 5 | 1.48 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', '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 azidoethane?
The IUPAC name of azidoethane (CID 59509168) is azidoethane.
What is the SMILES notation for azidoethane?
The canonical SMILES for azidoethane is C[CH+]N=[N+]=[N-].
What is the InChIKey of azidoethane?
The InChIKey is NJORHVBPLDZNDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4N3/c1-2-4-5-3/h2H,1H3/q+1.
What are the key properties of azidoethane?
azidoethane has a molecular weight of 70.07 g/mol, XLogP of 1.48, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for azidoethane is sourced from PubChem (CID 59509168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).