About N'-hydroxy-4-propylbenzohydrazide
N'-hydroxy-4-propylbenzohydrazide (PubChem CID 18359035) has the molecular formula C10H14N2O2
and a molecular weight of 194.23 g/mol. Its IUPAC name is N'-hydroxy-4-propylbenzohydrazide.
Molecular Properties
| Compound Name | N'-hydroxy-4-propylbenzohydrazide |
| PubChem CID | 18359035 |
| Molecular Formula | C10H14N2O2 |
| Molecular Weight | 194.23 g/mol |
| Exact Mass | 194.11 |
| IUPAC Name | N'-hydroxy-4-propylbenzohydrazide |
| SMILES | CCCc1ccc(C(=O)NNO)cc1 |
| InChI | InChI=1S/C10H14N2O2/c1-2-3-8-4-6-9(7-5-8)10(13)11-12-14/h4-7,12,14H,2-3H2,1H3,(H,11,13) |
| InChIKey | MKJXRIGICOPJDH-UHFFFAOYSA-N |
| XLogP | 1.26 |
| TPSA | 61.36 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 194.23 |
| LogP ≤ 5 | 1.26 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'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-propylbenzohydrazide?
The IUPAC name of N'-hydroxy-4-propylbenzohydrazide (CID 18359035) is N'-hydroxy-4-propylbenzohydrazide.
What is the SMILES notation for N'-hydroxy-4-propylbenzohydrazide?
The canonical SMILES for N'-hydroxy-4-propylbenzohydrazide is CCCc1ccc(C(=O)NNO)cc1.
What is the InChIKey of N'-hydroxy-4-propylbenzohydrazide?
The InChIKey is MKJXRIGICOPJDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-2-3-8-4-6-9(7-5-8)10(13)11-12-14/h4-7,12,14H,2-3H2,1H3,(H,11,13).
What are the key properties of N'-hydroxy-4-propylbenzohydrazide?
N'-hydroxy-4-propylbenzohydrazide has a molecular weight of 194.23 g/mol, XLogP of 1.26, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-4-propylbenzohydrazide is sourced from PubChem (CID 18359035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).