About 4-hydrazinyl-2-methyl-N-(5-methyl-3-pyridinyl)benzamide
4-hydrazinyl-2-methyl-N-(5-methyl-3-pyridinyl)benzamide (PubChem CID 107586747) has the molecular formula C14H16N4O
and a molecular weight of 256.31 g/mol. Its IUPAC name is 4-hydrazinyl-2-methyl-N-(5-methyl-3-pyridinyl)benzamide.
Molecular Properties
| Compound Name | 4-hydrazinyl-2-methyl-N-(5-methyl-3-pyridinyl)benzamide |
| PubChem CID | 107586747 |
| Molecular Formula | C14H16N4O |
| Molecular Weight | 256.31 g/mol |
| Exact Mass | 256.13 |
| IUPAC Name | 4-hydrazinyl-2-methyl-N-(5-methyl-3-pyridinyl)benzamide |
| SMILES | Cc1cncc(NC(=O)c2ccc(NN)cc2C)c1 |
| InChI | InChI=1S/C14H16N4O/c1-9-5-12(8-16-7-9)17-14(19)13-4-3-11(18-15)6-10(13)2/h3-8,18H,15H2,1-2H3,(H,17,19) |
| InChIKey | FESJPNFZCCSRMW-UHFFFAOYSA-N |
| XLogP | 2.24 |
| TPSA | 80.04 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 256.31 |
| LogP ≤ 5 | 2.24 |
| 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-2-methyl-N-(5-methyl-3-pyridinyl)benzamide?
The IUPAC name of 4-hydrazinyl-2-methyl-N-(5-methyl-3-pyridinyl)benzamide (CID 107586747) is 4-hydrazinyl-2-methyl-N-(5-methyl-3-pyridinyl)benzamide.
What is the SMILES notation for 4-hydrazinyl-2-methyl-N-(5-methyl-3-pyridinyl)benzamide?
The canonical SMILES for 4-hydrazinyl-2-methyl-N-(5-methyl-3-pyridinyl)benzamide is Cc1cncc(NC(=O)c2ccc(NN)cc2C)c1.
What is the InChIKey of 4-hydrazinyl-2-methyl-N-(5-methyl-3-pyridinyl)benzamide?
The InChIKey is FESJPNFZCCSRMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O/c1-9-5-12(8-16-7-9)17-14(19)13-4-3-11(18-15)6-10(13)2/h3-8,18H,15H2,1-2H3,(H,17,19).
What are the key properties of 4-hydrazinyl-2-methyl-N-(5-methyl-3-pyridinyl)benzamide?
4-hydrazinyl-2-methyl-N-(5-methyl-3-pyridinyl)benzamide has a molecular weight of 256.31 g/mol, XLogP of 2.24, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-2-methyl-N-(5-methyl-3-pyridinyl)benzamide is sourced from PubChem (CID 107586747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).