About N-hydroxy-2-methyl-3-phenylbenzamide
N-hydroxy-2-methyl-3-phenylbenzamide (PubChem CID 54333518) has the molecular formula C14H13NO2
and a molecular weight of 227.26 g/mol. Its IUPAC name is N-hydroxy-2-methyl-3-phenylbenzamide.
Molecular Properties
| Compound Name | N-hydroxy-2-methyl-3-phenylbenzamide |
| PubChem CID | 54333518 |
| Molecular Formula | C14H13NO2 |
| Molecular Weight | 227.26 g/mol |
| Exact Mass | 227.09 |
| IUPAC Name | N-hydroxy-2-methyl-3-phenylbenzamide |
| SMILES | Cc1c(C(=O)NO)cccc1-c1ccccc1 |
| InChI | InChI=1S/C14H13NO2/c1-10-12(11-6-3-2-4-7-11)8-5-9-13(10)14(16)15-17/h2-9,17H,1H3,(H,15,16) |
| InChIKey | SZZPTPVPEZAMAO-UHFFFAOYSA-N |
| XLogP | 2.78 |
| TPSA | 49.33 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 227.26 |
| LogP ≤ 5 | 2.78 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'hydroxamic_acid', '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-hydroxy-2-methyl-3-phenylbenzamide?
The IUPAC name of N-hydroxy-2-methyl-3-phenylbenzamide (CID 54333518) is N-hydroxy-2-methyl-3-phenylbenzamide.
What is the SMILES notation for N-hydroxy-2-methyl-3-phenylbenzamide?
The canonical SMILES for N-hydroxy-2-methyl-3-phenylbenzamide is Cc1c(C(=O)NO)cccc1-c1ccccc1.
What is the InChIKey of N-hydroxy-2-methyl-3-phenylbenzamide?
The InChIKey is SZZPTPVPEZAMAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NO2/c1-10-12(11-6-3-2-4-7-11)8-5-9-13(10)14(16)15-17/h2-9,17H,1H3,(H,15,16).
What are the key properties of N-hydroxy-2-methyl-3-phenylbenzamide?
N-hydroxy-2-methyl-3-phenylbenzamide has a molecular weight of 227.26 g/mol, XLogP of 2.78, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-methyl-3-phenylbenzamide is sourced from PubChem (CID 54333518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).