About 4-hydrazinyl-N-(2-phenylcyclopropyl)benzamide
4-hydrazinyl-N-(2-phenylcyclopropyl)benzamide (PubChem CID 62249097) has the molecular formula C16H17N3O
and a molecular weight of 267.33 g/mol. Its IUPAC name is 4-hydrazinyl-N-(2-phenylcyclopropyl)benzamide.
Molecular Properties
| Compound Name | 4-hydrazinyl-N-(2-phenylcyclopropyl)benzamide |
| PubChem CID | 62249097 |
| Molecular Formula | C16H17N3O |
| Molecular Weight | 267.33 g/mol |
| Exact Mass | 267.14 |
| IUPAC Name | 4-hydrazinyl-N-(2-phenylcyclopropyl)benzamide |
| SMILES | NNc1ccc(C(=O)NC2CC2c2ccccc2)cc1 |
| InChI | InChI=1S/C16H17N3O/c17-19-13-8-6-12(7-9-13)16(20)18-15-10-14(15)11-4-2-1-3-5-11/h1-9,14-15,19H,10,17H2,(H,18,20) |
| InChIKey | PWZCHJZZDJVMKV-UHFFFAOYSA-N |
| XLogP | 2.26 |
| TPSA | 67.15 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 267.33 |
| LogP ≤ 5 | 2.26 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'hydrazine', '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 4-hydrazinyl-N-(2-phenylcyclopropyl)benzamide?
The IUPAC name of 4-hydrazinyl-N-(2-phenylcyclopropyl)benzamide (CID 62249097) is 4-hydrazinyl-N-(2-phenylcyclopropyl)benzamide.
What is the SMILES notation for 4-hydrazinyl-N-(2-phenylcyclopropyl)benzamide?
The canonical SMILES for 4-hydrazinyl-N-(2-phenylcyclopropyl)benzamide is NNc1ccc(C(=O)NC2CC2c2ccccc2)cc1.
What is the InChIKey of 4-hydrazinyl-N-(2-phenylcyclopropyl)benzamide?
The InChIKey is PWZCHJZZDJVMKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O/c17-19-13-8-6-12(7-9-13)16(20)18-15-10-14(15)11-4-2-1-3-5-11/h1-9,14-15,19H,10,17H2,(H,18,20).
What are the key properties of 4-hydrazinyl-N-(2-phenylcyclopropyl)benzamide?
4-hydrazinyl-N-(2-phenylcyclopropyl)benzamide has a molecular weight of 267.33 g/mol, XLogP of 2.26, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-N-(2-phenylcyclopropyl)benzamide is sourced from PubChem (CID 62249097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).