About 2-amino-5-hydroxy-N-(2-iodophenyl)benzamide
2-amino-5-hydroxy-N-(2-iodophenyl)benzamide (PubChem CID 107073971) has the molecular formula C13H11IN2O2
and a molecular weight of 354.15 g/mol. Its IUPAC name is 2-amino-5-hydroxy-N-(2-iodophenyl)benzamide.
Molecular Properties
| Compound Name | 2-amino-5-hydroxy-N-(2-iodophenyl)benzamide |
| PubChem CID | 107073971 |
| Molecular Formula | C13H11IN2O2 |
| Molecular Weight | 354.15 g/mol |
| Exact Mass | 353.99 |
| IUPAC Name | 2-amino-5-hydroxy-N-(2-iodophenyl)benzamide |
| SMILES | Nc1ccc(O)cc1C(=O)Nc1ccccc1I |
| InChI | InChI=1S/C13H11IN2O2/c14-10-3-1-2-4-12(10)16-13(18)9-7-8(17)5-6-11(9)15/h1-7,17H,15H2,(H,16,18) |
| InChIKey | XFYMPTZEQOXNAH-UHFFFAOYSA-N |
| XLogP | 2.83 |
| TPSA | 75.35 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 354.15 |
| LogP ≤ 5 | 2.83 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'hydroquinone', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 2-amino-5-hydroxy-N-(2-iodophenyl)benzamide?
The IUPAC name of 2-amino-5-hydroxy-N-(2-iodophenyl)benzamide (CID 107073971) is 2-amino-5-hydroxy-N-(2-iodophenyl)benzamide.
What is the SMILES notation for 2-amino-5-hydroxy-N-(2-iodophenyl)benzamide?
The canonical SMILES for 2-amino-5-hydroxy-N-(2-iodophenyl)benzamide is Nc1ccc(O)cc1C(=O)Nc1ccccc1I.
What is the InChIKey of 2-amino-5-hydroxy-N-(2-iodophenyl)benzamide?
The InChIKey is XFYMPTZEQOXNAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11IN2O2/c14-10-3-1-2-4-12(10)16-13(18)9-7-8(17)5-6-11(9)15/h1-7,17H,15H2,(H,16,18).
What are the key properties of 2-amino-5-hydroxy-N-(2-iodophenyl)benzamide?
2-amino-5-hydroxy-N-(2-iodophenyl)benzamide has a molecular weight of 354.15 g/mol, XLogP of 2.83, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-hydroxy-N-(2-iodophenyl)benzamide is sourced from PubChem (CID 107073971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).