About [2-methoxy-3-methyl-1-(4-phenylphenyl)butyl]hydrazine
[2-methoxy-3-methyl-1-(4-phenylphenyl)butyl]hydrazine (PubChem CID 105271982) has the molecular formula C18H24N2O
and a molecular weight of 284.40 g/mol. Its IUPAC name is [2-methoxy-3-methyl-1-(4-phenylphenyl)butyl]hydrazine.
Molecular Properties
| Compound Name | [2-methoxy-3-methyl-1-(4-phenylphenyl)butyl]hydrazine |
| PubChem CID | 105271982 |
| Molecular Formula | C18H24N2O |
| Molecular Weight | 284.40 g/mol |
| Exact Mass | 284.19 |
| IUPAC Name | [2-methoxy-3-methyl-1-(4-phenylphenyl)butyl]hydrazine |
| SMILES | COC(C(C)C)C(NN)c1ccc(-c2ccccc2)cc1 |
| InChI | InChI=1S/C18H24N2O/c1-13(2)18(21-3)17(20-19)16-11-9-15(10-12-16)14-7-5-4-6-8-14/h4-13,17-18,20H,19H2,1-3H3 |
| InChIKey | UIJGXWZMWWKWIC-UHFFFAOYSA-N |
| XLogP | 3.53 |
| TPSA | 47.28 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 284.40 |
| LogP ≤ 5 | 3.53 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
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-methoxy-3-methyl-1-(4-phenylphenyl)butyl]hydrazine?
The IUPAC name of [2-methoxy-3-methyl-1-(4-phenylphenyl)butyl]hydrazine (CID 105271982) is [2-methoxy-3-methyl-1-(4-phenylphenyl)butyl]hydrazine.
What is the SMILES notation for [2-methoxy-3-methyl-1-(4-phenylphenyl)butyl]hydrazine?
The canonical SMILES for [2-methoxy-3-methyl-1-(4-phenylphenyl)butyl]hydrazine is COC(C(C)C)C(NN)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of [2-methoxy-3-methyl-1-(4-phenylphenyl)butyl]hydrazine?
The InChIKey is UIJGXWZMWWKWIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-13(2)18(21-3)17(20-19)16-11-9-15(10-12-16)14-7-5-4-6-8-14/h4-13,17-18,20H,19H2,1-3H3.
What are the key properties of [2-methoxy-3-methyl-1-(4-phenylphenyl)butyl]hydrazine?
[2-methoxy-3-methyl-1-(4-phenylphenyl)butyl]hydrazine has a molecular weight of 284.40 g/mol, XLogP of 3.53, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methoxy-3-methyl-1-(4-phenylphenyl)butyl]hydrazine is sourced from PubChem (CID 105271982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).