About CID 18407106
CID 18407106 (PubChem CID 18407106) has the molecular formula H4N2O2S
and a molecular weight of 96.11 g/mol.
Molecular Properties
| Compound Name | CID 18407106 |
| PubChem CID | 18407106 |
| Molecular Formula | H4N2O2S |
| Molecular Weight | 96.11 g/mol |
| Exact Mass | 96.00 |
| IUPAC Name | — |
| SMILES | NNS(=O)O |
| InChI | InChI=1S/H4N2O2S/c1-2-5(3)4/h2H,1H2,(H,3,4) |
| InChIKey | MPDGHNNPLVGRFC-UHFFFAOYSA-N |
| XLogP | -1.41 |
| TPSA | 75.35 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 5 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 96.11 |
| LogP ≤ 5 | -1.41 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'sulfinic_acid', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of CID 18407106?
The IUPAC name of CID 18407106 (CID 18407106) is not available.
What is the SMILES notation for CID 18407106?
The canonical SMILES for CID 18407106 is NNS(=O)O.
What is the InChIKey of CID 18407106?
The InChIKey is MPDGHNNPLVGRFC-UHFFFAOYSA-N. The full InChI is InChI=1S/H4N2O2S/c1-2-5(3)4/h2H,1H2,(H,3,4).
What are the key properties of CID 18407106?
CID 18407106 has a molecular weight of 96.11 g/mol, XLogP of -1.41, 1 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 18407106 is sourced from PubChem (CID 18407106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).