About 2-hydrazinyl-N-propylbenzamide
2-hydrazinyl-N-propylbenzamide (PubChem CID 62238054) has the molecular formula C10H15N3O
and a molecular weight of 193.25 g/mol. Its IUPAC name is 2-hydrazinyl-N-propylbenzamide.
Molecular Properties
| Compound Name | 2-hydrazinyl-N-propylbenzamide |
| PubChem CID | 62238054 |
| Molecular Formula | C10H15N3O |
| Molecular Weight | 193.25 g/mol |
| Exact Mass | 193.12 |
| IUPAC Name | 2-hydrazinyl-N-propylbenzamide |
| SMILES | CCCNC(=O)C1=CC=CC=C1NN |
| InChI | InChI=1S/C10H15N3O/c1-2-7-12-10(14)8-5-3-4-6-9(8)13-11/h3-6,13H,2,7,11H2,1H3,(H,12,14) |
| InChIKey | VPYHGARAQQGPAM-UHFFFAOYSA-N |
| XLogP | 1.90 |
| TPSA | 67.20 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 14 |
| Complexity | 184 |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 193.25 |
| LogP ≤ 5 | 1.90 |
| 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 2-hydrazinyl-N-propylbenzamide?
The IUPAC name of 2-hydrazinyl-N-propylbenzamide (CID 62238054) is 2-hydrazinyl-N-propylbenzamide.
What is the SMILES notation for 2-hydrazinyl-N-propylbenzamide?
The canonical SMILES for 2-hydrazinyl-N-propylbenzamide is CCCNC(=O)C1=CC=CC=C1NN.
What is the InChIKey of 2-hydrazinyl-N-propylbenzamide?
The InChIKey is VPYHGARAQQGPAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-2-7-12-10(14)8-5-3-4-6-9(8)13-11/h3-6,13H,2,7,11H2,1H3,(H,12,14).
What are the key properties of 2-hydrazinyl-N-propylbenzamide?
2-hydrazinyl-N-propylbenzamide has a molecular weight of 193.25 g/mol, XLogP of 1.90, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-N-propylbenzamide is sourced from PubChem (CID 62238054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).