About N-benzoyl-4-methylbenzohydrazide
N-benzoyl-4-methylbenzohydrazide (PubChem CID 174274321) has the molecular formula C15H14N2O2
and a molecular weight of 254.29 g/mol. Its IUPAC name is N-benzoyl-4-methylbenzohydrazide.
Molecular Properties
| Compound Name | N-benzoyl-4-methylbenzohydrazide |
| PubChem CID | 174274321 |
| Molecular Formula | C15H14N2O2 |
| Molecular Weight | 254.29 g/mol |
| Exact Mass | 254.11 |
| IUPAC Name | N-benzoyl-4-methylbenzohydrazide |
| SMILES | Cc1ccc(C(=O)N(N)C(=O)c2ccccc2)cc1 |
| InChI | InChI=1S/C15H14N2O2/c1-11-7-9-13(10-8-11)15(19)17(16)14(18)12-5-3-2-4-6-12/h2-10H,16H2,1H3 |
| InChIKey | QMAGECARLWMYQA-UHFFFAOYSA-N |
| XLogP | 2.15 |
| TPSA | 63.40 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 254.29 |
| LogP ≤ 5 | 2.15 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-benzoyl-4-methylbenzohydrazide?
The IUPAC name of N-benzoyl-4-methylbenzohydrazide (CID 174274321) is N-benzoyl-4-methylbenzohydrazide.
What is the SMILES notation for N-benzoyl-4-methylbenzohydrazide?
The canonical SMILES for N-benzoyl-4-methylbenzohydrazide is Cc1ccc(C(=O)N(N)C(=O)c2ccccc2)cc1.
What is the InChIKey of N-benzoyl-4-methylbenzohydrazide?
The InChIKey is QMAGECARLWMYQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O2/c1-11-7-9-13(10-8-11)15(19)17(16)14(18)12-5-3-2-4-6-12/h2-10H,16H2,1H3.
What are the key properties of N-benzoyl-4-methylbenzohydrazide?
N-benzoyl-4-methylbenzohydrazide has a molecular weight of 254.29 g/mol, XLogP of 2.15, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzoyl-4-methylbenzohydrazide is sourced from PubChem (CID 174274321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).