About [(2-bromo-5-methoxyphenyl)-(3-methoxyphenyl)methyl]hydrazine
[(2-bromo-5-methoxyphenyl)-(3-methoxyphenyl)methyl]hydrazine (PubChem CID 105283642) has the molecular formula C15H17BrN2O2
and a molecular weight of 337.22 g/mol. Its IUPAC name is [(2-bromo-5-methoxyphenyl)-(3-methoxyphenyl)methyl]hydrazine.
Molecular Properties
| Compound Name | [(2-bromo-5-methoxyphenyl)-(3-methoxyphenyl)methyl]hydrazine |
| PubChem CID | 105283642 |
| Molecular Formula | C15H17BrN2O2 |
| Molecular Weight | 337.22 g/mol |
| Exact Mass | 336.05 |
| IUPAC Name | [(2-bromo-5-methoxyphenyl)-(3-methoxyphenyl)methyl]hydrazine |
| SMILES | COc1cccc(C(NN)c2cc(OC)ccc2Br)c1 |
| InChI | InChI=1S/C15H17BrN2O2/c1-19-11-5-3-4-10(8-11)15(18-17)13-9-12(20-2)6-7-14(13)16/h3-9,15,18H,17H2,1-2H3 |
| InChIKey | ZWZURGJLKFBQKB-UHFFFAOYSA-N |
| XLogP | 3.02 |
| TPSA | 56.51 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 337.22 |
| LogP ≤ 5 | 3.02 |
| 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-bromo-5-methoxyphenyl)-(3-methoxyphenyl)methyl]hydrazine?
The IUPAC name of [(2-bromo-5-methoxyphenyl)-(3-methoxyphenyl)methyl]hydrazine (CID 105283642) is [(2-bromo-5-methoxyphenyl)-(3-methoxyphenyl)methyl]hydrazine.
What is the SMILES notation for [(2-bromo-5-methoxyphenyl)-(3-methoxyphenyl)methyl]hydrazine?
The canonical SMILES for [(2-bromo-5-methoxyphenyl)-(3-methoxyphenyl)methyl]hydrazine is COc1cccc(C(NN)c2cc(OC)ccc2Br)c1.
What is the InChIKey of [(2-bromo-5-methoxyphenyl)-(3-methoxyphenyl)methyl]hydrazine?
The InChIKey is ZWZURGJLKFBQKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17BrN2O2/c1-19-11-5-3-4-10(8-11)15(18-17)13-9-12(20-2)6-7-14(13)16/h3-9,15,18H,17H2,1-2H3.
What are the key properties of [(2-bromo-5-methoxyphenyl)-(3-methoxyphenyl)methyl]hydrazine?
[(2-bromo-5-methoxyphenyl)-(3-methoxyphenyl)methyl]hydrazine has a molecular weight of 337.22 g/mol, XLogP of 3.02, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-bromo-5-methoxyphenyl)-(3-methoxyphenyl)methyl]hydrazine is sourced from PubChem (CID 105283642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).