About N-[4-(hydroxysulfamoyl)phenyl]formamide
N-[4-(hydroxysulfamoyl)phenyl]formamide (PubChem CID 89316747) has the molecular formula C7H8N2O4S
and a molecular weight of 216.22 g/mol. Its IUPAC name is N-[4-(hydroxysulfamoyl)phenyl]formamide.
Molecular Properties
| Compound Name | N-[4-(hydroxysulfamoyl)phenyl]formamide |
| PubChem CID | 89316747 |
| Molecular Formula | C7H8N2O4S |
| Molecular Weight | 216.22 g/mol |
| Exact Mass | 216.02 |
| IUPAC Name | N-[4-(hydroxysulfamoyl)phenyl]formamide |
| SMILES | O=CNc1ccc(S(=O)(=O)NO)cc1 |
| InChI | InChI=1S/C7H8N2O4S/c10-5-8-6-1-3-7(4-2-6)14(12,13)9-11/h1-5,9,11H,(H,8,10) |
| InChIKey | IMTUOIHEHKYRDB-UHFFFAOYSA-N |
| XLogP | -0.08 |
| TPSA | 95.50 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 216.22 |
| LogP ≤ 5 | -0.08 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 4 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-[4-(hydroxysulfamoyl)phenyl]formamide?
The IUPAC name of N-[4-(hydroxysulfamoyl)phenyl]formamide (CID 89316747) is N-[4-(hydroxysulfamoyl)phenyl]formamide.
What is the SMILES notation for N-[4-(hydroxysulfamoyl)phenyl]formamide?
The canonical SMILES for N-[4-(hydroxysulfamoyl)phenyl]formamide is O=CNc1ccc(S(=O)(=O)NO)cc1.
What is the InChIKey of N-[4-(hydroxysulfamoyl)phenyl]formamide?
The InChIKey is IMTUOIHEHKYRDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O4S/c10-5-8-6-1-3-7(4-2-6)14(12,13)9-11/h1-5,9,11H,(H,8,10).
What are the key properties of N-[4-(hydroxysulfamoyl)phenyl]formamide?
N-[4-(hydroxysulfamoyl)phenyl]formamide has a molecular weight of 216.22 g/mol, XLogP of -0.08, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(hydroxysulfamoyl)phenyl]formamide is sourced from PubChem (CID 89316747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).