About N-hydroxy-4-[[(2-phenylacetyl)-(2-phenylethyl)amino]methyl]benzamide
N-hydroxy-4-[[(2-phenylacetyl)-(2-phenylethyl)amino]methyl]benzamide (PubChem CID 147494656) has the molecular formula C24H24N2O3
and a molecular weight of 388.47 g/mol. Its IUPAC name is N-hydroxy-4-[[(2-phenylacetyl)-(2-phenylethyl)amino]methyl]benzamide.
Molecular Properties
| Compound Name | N-hydroxy-4-[[(2-phenylacetyl)-(2-phenylethyl)amino]methyl]benzamide |
| PubChem CID | 147494656 |
| Molecular Formula | C24H24N2O3 |
| Molecular Weight | 388.47 g/mol |
| Exact Mass | 388.18 |
| IUPAC Name | N-hydroxy-4-[[(2-phenylacetyl)-(2-phenylethyl)amino]methyl]benzamide |
| SMILES | O=C(NO)c1ccc(CN(CCc2ccccc2)C(=O)Cc2ccccc2)cc1 |
| InChI | InChI=1S/C24H24N2O3/c27-23(17-20-9-5-2-6-10-20)26(16-15-19-7-3-1-4-8-19)18-21-11-13-22(14-12-21)24(28)25-29/h1-14,29H,15-18H2,(H,25,28) |
| InChIKey | FGFADNWOFJLWQU-UHFFFAOYSA-N |
| XLogP | 3.62 |
| TPSA | 69.64 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Heavy Atoms | 29 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 388.47 |
| LogP ≤ 5 | 3.62 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
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-4-[[(2-phenylacetyl)-(2-phenylethyl)amino]methyl]benzamide?
The IUPAC name of N-hydroxy-4-[[(2-phenylacetyl)-(2-phenylethyl)amino]methyl]benzamide (CID 147494656) is N-hydroxy-4-[[(2-phenylacetyl)-(2-phenylethyl)amino]methyl]benzamide.
What is the SMILES notation for N-hydroxy-4-[[(2-phenylacetyl)-(2-phenylethyl)amino]methyl]benzamide?
The canonical SMILES for N-hydroxy-4-[[(2-phenylacetyl)-(2-phenylethyl)amino]methyl]benzamide is O=C(NO)c1ccc(CN(CCc2ccccc2)C(=O)Cc2ccccc2)cc1.
What is the InChIKey of N-hydroxy-4-[[(2-phenylacetyl)-(2-phenylethyl)amino]methyl]benzamide?
The InChIKey is FGFADNWOFJLWQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O3/c27-23(17-20-9-5-2-6-10-20)26(16-15-19-7-3-1-4-8-19)18-21-11-13-22(14-12-21)24(28)25-29/h1-14,29H,15-18H2,(H,25,28).
What are the key properties of N-hydroxy-4-[[(2-phenylacetyl)-(2-phenylethyl)amino]methyl]benzamide?
N-hydroxy-4-[[(2-phenylacetyl)-(2-phenylethyl)amino]methyl]benzamide has a molecular weight of 388.47 g/mol, XLogP of 3.62, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-4-[[(2-phenylacetyl)-(2-phenylethyl)amino]methyl]benzamide is sourced from PubChem (CID 147494656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).