About [(4-bromo-3-chloro-2-fluorophenyl)-pyridin-2-ylmethyl]hydrazine
[(4-bromo-3-chloro-2-fluorophenyl)-pyridin-2-ylmethyl]hydrazine (PubChem CID 106765183) has the molecular formula C12H10BrClFN3
and a molecular weight of 330.59 g/mol. Its IUPAC name is [(4-bromo-3-chloro-2-fluorophenyl)-pyridin-2-ylmethyl]hydrazine.
Molecular Properties
| Compound Name | [(4-bromo-3-chloro-2-fluorophenyl)-pyridin-2-ylmethyl]hydrazine |
| PubChem CID | 106765183 |
| Molecular Formula | C12H10BrClFN3 |
| Molecular Weight | 330.59 g/mol |
| Exact Mass | 328.97 |
| IUPAC Name | [(4-bromo-3-chloro-2-fluorophenyl)-pyridin-2-ylmethyl]hydrazine |
| SMILES | NNC(c1ccccn1)c1ccc(Br)c(Cl)c1F |
| InChI | InChI=1S/C12H10BrClFN3/c13-8-5-4-7(11(15)10(8)14)12(18-16)9-3-1-2-6-17-9/h1-6,12,18H,16H2 |
| InChIKey | DBWVOGSBMLATST-UHFFFAOYSA-N |
| XLogP | 3.19 |
| TPSA | 50.94 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 330.59 |
| LogP ≤ 5 | 3.19 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'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-bromo-3-chloro-2-fluorophenyl)-pyridin-2-ylmethyl]hydrazine?
The IUPAC name of [(4-bromo-3-chloro-2-fluorophenyl)-pyridin-2-ylmethyl]hydrazine (CID 106765183) is [(4-bromo-3-chloro-2-fluorophenyl)-pyridin-2-ylmethyl]hydrazine.
What is the SMILES notation for [(4-bromo-3-chloro-2-fluorophenyl)-pyridin-2-ylmethyl]hydrazine?
The canonical SMILES for [(4-bromo-3-chloro-2-fluorophenyl)-pyridin-2-ylmethyl]hydrazine is NNC(c1ccccn1)c1ccc(Br)c(Cl)c1F.
What is the InChIKey of [(4-bromo-3-chloro-2-fluorophenyl)-pyridin-2-ylmethyl]hydrazine?
The InChIKey is DBWVOGSBMLATST-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10BrClFN3/c13-8-5-4-7(11(15)10(8)14)12(18-16)9-3-1-2-6-17-9/h1-6,12,18H,16H2.
What are the key properties of [(4-bromo-3-chloro-2-fluorophenyl)-pyridin-2-ylmethyl]hydrazine?
[(4-bromo-3-chloro-2-fluorophenyl)-pyridin-2-ylmethyl]hydrazine has a molecular weight of 330.59 g/mol, XLogP of 3.19, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-bromo-3-chloro-2-fluorophenyl)-pyridin-2-ylmethyl]hydrazine is sourced from PubChem (CID 106765183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).