About 1-[(3-methoxy-2-methylphenyl)methyl]-1-methylhydrazine
1-[(3-methoxy-2-methylphenyl)methyl]-1-methylhydrazine (PubChem CID 119090080) has the molecular formula C10H16N2O
and a molecular weight of 180.25 g/mol. Its IUPAC name is 1-[(3-methoxy-2-methylphenyl)methyl]-1-methylhydrazine.
Molecular Properties
| Compound Name | 1-[(3-methoxy-2-methylphenyl)methyl]-1-methylhydrazine |
| PubChem CID | 119090080 |
| Molecular Formula | C10H16N2O |
| Molecular Weight | 180.25 g/mol |
| Exact Mass | 180.13 |
| IUPAC Name | 1-[(3-methoxy-2-methylphenyl)methyl]-1-methylhydrazine |
| SMILES | COc1cccc(CN(C)N)c1C |
| InChI | InChI=1S/C10H16N2O/c1-8-9(7-12(2)11)5-4-6-10(8)13-3/h4-6H,7,11H2,1-3H3 |
| InChIKey | MRCXLEYXCFECHH-UHFFFAOYSA-N |
| XLogP | 1.31 |
| TPSA | 38.49 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 180.25 |
| LogP ≤ 5 | 1.31 |
| H-Bond Donors ≤ 5 | 1 |
| 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 1-[(3-methoxy-2-methylphenyl)methyl]-1-methylhydrazine?
The IUPAC name of 1-[(3-methoxy-2-methylphenyl)methyl]-1-methylhydrazine (CID 119090080) is 1-[(3-methoxy-2-methylphenyl)methyl]-1-methylhydrazine.
What is the SMILES notation for 1-[(3-methoxy-2-methylphenyl)methyl]-1-methylhydrazine?
The canonical SMILES for 1-[(3-methoxy-2-methylphenyl)methyl]-1-methylhydrazine is COc1cccc(CN(C)N)c1C.
What is the InChIKey of 1-[(3-methoxy-2-methylphenyl)methyl]-1-methylhydrazine?
The InChIKey is MRCXLEYXCFECHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-8-9(7-12(2)11)5-4-6-10(8)13-3/h4-6H,7,11H2,1-3H3.
What are the key properties of 1-[(3-methoxy-2-methylphenyl)methyl]-1-methylhydrazine?
1-[(3-methoxy-2-methylphenyl)methyl]-1-methylhydrazine has a molecular weight of 180.25 g/mol, XLogP of 1.31, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-methoxy-2-methylphenyl)methyl]-1-methylhydrazine is sourced from PubChem (CID 119090080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).