About N-hydroxy-N-(4-pyridin-4-ylphenyl)benzamide
N-hydroxy-N-(4-pyridin-4-ylphenyl)benzamide (PubChem CID 87974720) has the molecular formula C18H14N2O2
and a molecular weight of 290.32 g/mol. Its IUPAC name is N-hydroxy-N-(4-pyridin-4-ylphenyl)benzamide.
Molecular Properties
| Compound Name | N-hydroxy-N-(4-pyridin-4-ylphenyl)benzamide |
| PubChem CID | 87974720 |
| Molecular Formula | C18H14N2O2 |
| Molecular Weight | 290.32 g/mol |
| Exact Mass | 290.11 |
| IUPAC Name | N-hydroxy-N-(4-pyridin-4-ylphenyl)benzamide |
| SMILES | O=C(c1ccccc1)N(O)c1ccc(-c2ccncc2)cc1 |
| InChI | InChI=1S/C18H14N2O2/c21-18(16-4-2-1-3-5-16)20(22)17-8-6-14(7-9-17)15-10-12-19-13-11-15/h1-13,22H |
| InChIKey | HDFPWHYQEIMCOE-UHFFFAOYSA-N |
| XLogP | 3.78 |
| TPSA | 53.43 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 22 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 290.32 |
| LogP ≤ 5 | 3.78 |
| H-Bond Donors ≤ 5 | 1 |
| 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-N-(4-pyridin-4-ylphenyl)benzamide?
The IUPAC name of N-hydroxy-N-(4-pyridin-4-ylphenyl)benzamide (CID 87974720) is N-hydroxy-N-(4-pyridin-4-ylphenyl)benzamide.
What is the SMILES notation for N-hydroxy-N-(4-pyridin-4-ylphenyl)benzamide?
The canonical SMILES for N-hydroxy-N-(4-pyridin-4-ylphenyl)benzamide is O=C(c1ccccc1)N(O)c1ccc(-c2ccncc2)cc1.
What is the InChIKey of N-hydroxy-N-(4-pyridin-4-ylphenyl)benzamide?
The InChIKey is HDFPWHYQEIMCOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N2O2/c21-18(16-4-2-1-3-5-16)20(22)17-8-6-14(7-9-17)15-10-12-19-13-11-15/h1-13,22H.
What are the key properties of N-hydroxy-N-(4-pyridin-4-ylphenyl)benzamide?
N-hydroxy-N-(4-pyridin-4-ylphenyl)benzamide has a molecular weight of 290.32 g/mol, XLogP of 3.78, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-N-(4-pyridin-4-ylphenyl)benzamide is sourced from PubChem (CID 87974720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).