About N-(2-bromo-3-chlorophenyl)-5-hydrazinylpyridine-2-carboxamide
N-(2-bromo-3-chlorophenyl)-5-hydrazinylpyridine-2-carboxamide (PubChem CID 103481467) has the molecular formula C12H10BrClN4O
and a molecular weight of 341.60 g/mol. Its IUPAC name is N-(2-bromo-3-chlorophenyl)-5-hydrazinylpyridine-2-carboxamide.
Molecular Properties
| Compound Name | N-(2-bromo-3-chlorophenyl)-5-hydrazinylpyridine-2-carboxamide |
| PubChem CID | 103481467 |
| Molecular Formula | C12H10BrClN4O |
| Molecular Weight | 341.60 g/mol |
| Exact Mass | 339.97 |
| IUPAC Name | N-(2-bromo-3-chlorophenyl)-5-hydrazinylpyridine-2-carboxamide |
| SMILES | NNc1ccc(C(=O)Nc2cccc(Cl)c2Br)nc1 |
| InChI | InChI=1S/C12H10BrClN4O/c13-11-8(14)2-1-3-9(11)17-12(19)10-5-4-7(18-15)6-16-10/h1-6,18H,15H2,(H,17,19) |
| InChIKey | NZJYHXGHBHVDMB-UHFFFAOYSA-N |
| XLogP | 3.04 |
| 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 | 341.60 |
| LogP ≤ 5 | 3.04 |
| 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 N-(2-bromo-3-chlorophenyl)-5-hydrazinylpyridine-2-carboxamide?
The IUPAC name of N-(2-bromo-3-chlorophenyl)-5-hydrazinylpyridine-2-carboxamide (CID 103481467) is N-(2-bromo-3-chlorophenyl)-5-hydrazinylpyridine-2-carboxamide.
What is the SMILES notation for N-(2-bromo-3-chlorophenyl)-5-hydrazinylpyridine-2-carboxamide?
The canonical SMILES for N-(2-bromo-3-chlorophenyl)-5-hydrazinylpyridine-2-carboxamide is NNc1ccc(C(=O)Nc2cccc(Cl)c2Br)nc1.
What is the InChIKey of N-(2-bromo-3-chlorophenyl)-5-hydrazinylpyridine-2-carboxamide?
The InChIKey is NZJYHXGHBHVDMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10BrClN4O/c13-11-8(14)2-1-3-9(11)17-12(19)10-5-4-7(18-15)6-16-10/h1-6,18H,15H2,(H,17,19).
What are the key properties of N-(2-bromo-3-chlorophenyl)-5-hydrazinylpyridine-2-carboxamide?
N-(2-bromo-3-chlorophenyl)-5-hydrazinylpyridine-2-carboxamide has a molecular weight of 341.60 g/mol, XLogP of 3.04, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-3-chlorophenyl)-5-hydrazinylpyridine-2-carboxamide is sourced from PubChem (CID 103481467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).