About [2-(3-bromophenyl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine
[2-(3-bromophenyl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine (PubChem CID 105284546) has the molecular formula C14H16BrN3O
and a molecular weight of 322.21 g/mol. Its IUPAC name is [2-(3-bromophenyl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine.
Molecular Properties
| Compound Name | [2-(3-bromophenyl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine |
| PubChem CID | 105284546 |
| Molecular Formula | C14H16BrN3O |
| Molecular Weight | 322.21 g/mol |
| Exact Mass | 321.05 |
| IUPAC Name | [2-(3-bromophenyl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine |
| SMILES | COc1ncccc1C(Cc1cccc(Br)c1)NN |
| InChI | InChI=1S/C14H16BrN3O/c1-19-14-12(6-3-7-17-14)13(18-16)9-10-4-2-5-11(15)8-10/h2-8,13,18H,9,16H2,1H3 |
| InChIKey | BMFTWWMGTDKVGY-UHFFFAOYSA-N |
| XLogP | 2.60 |
| TPSA | 60.17 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 322.21 |
| LogP ≤ 5 | 2.60 |
| H-Bond Donors ≤ 5 | 2 |
| 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 [2-(3-bromophenyl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine?
The IUPAC name of [2-(3-bromophenyl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine (CID 105284546) is [2-(3-bromophenyl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine.
What is the SMILES notation for [2-(3-bromophenyl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine?
The canonical SMILES for [2-(3-bromophenyl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine is COc1ncccc1C(Cc1cccc(Br)c1)NN.
What is the InChIKey of [2-(3-bromophenyl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine?
The InChIKey is BMFTWWMGTDKVGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16BrN3O/c1-19-14-12(6-3-7-17-14)13(18-16)9-10-4-2-5-11(15)8-10/h2-8,13,18H,9,16H2,1H3.
What are the key properties of [2-(3-bromophenyl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine?
[2-(3-bromophenyl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine has a molecular weight of 322.21 g/mol, XLogP of 2.60, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-bromophenyl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine is sourced from PubChem (CID 105284546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).