About 4-hydrazinyl-N-(5-methyl-3-pyridinyl)benzamide
4-hydrazinyl-N-(5-methyl-3-pyridinyl)benzamide (PubChem CID 107586745) has the molecular formula C13H14N4O
and a molecular weight of 242.28 g/mol. Its IUPAC name is 4-hydrazinyl-N-(5-methyl-3-pyridinyl)benzamide.
Molecular Properties
| Compound Name | 4-hydrazinyl-N-(5-methyl-3-pyridinyl)benzamide |
| PubChem CID | 107586745 |
| Molecular Formula | C13H14N4O |
| Molecular Weight | 242.28 g/mol |
| Exact Mass | 242.12 |
| IUPAC Name | 4-hydrazinyl-N-(5-methyl-3-pyridinyl)benzamide |
| SMILES | Cc1cncc(NC(=O)c2ccc(NN)cc2)c1 |
| InChI | InChI=1S/C13H14N4O/c1-9-6-12(8-15-7-9)16-13(18)10-2-4-11(17-14)5-3-10/h2-8,17H,14H2,1H3,(H,16,18) |
| InChIKey | FGOZAMFRVWOIAN-UHFFFAOYSA-N |
| XLogP | 1.93 |
| TPSA | 80.04 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 242.28 |
| LogP ≤ 5 | 1.93 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 4 |
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-(5-methyl-3-pyridinyl)benzamide?
The IUPAC name of 4-hydrazinyl-N-(5-methyl-3-pyridinyl)benzamide (CID 107586745) is 4-hydrazinyl-N-(5-methyl-3-pyridinyl)benzamide.
What is the SMILES notation for 4-hydrazinyl-N-(5-methyl-3-pyridinyl)benzamide?
The canonical SMILES for 4-hydrazinyl-N-(5-methyl-3-pyridinyl)benzamide is Cc1cncc(NC(=O)c2ccc(NN)cc2)c1.
What is the InChIKey of 4-hydrazinyl-N-(5-methyl-3-pyridinyl)benzamide?
The InChIKey is FGOZAMFRVWOIAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O/c1-9-6-12(8-15-7-9)16-13(18)10-2-4-11(17-14)5-3-10/h2-8,17H,14H2,1H3,(H,16,18).
What are the key properties of 4-hydrazinyl-N-(5-methyl-3-pyridinyl)benzamide?
4-hydrazinyl-N-(5-methyl-3-pyridinyl)benzamide has a molecular weight of 242.28 g/mol, XLogP of 1.93, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-N-(5-methyl-3-pyridinyl)benzamide is sourced from PubChem (CID 107586745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).