About 1-(2-methoxyphenyl)-N-(4-methoxyphenyl)methanimine
1-(2-methoxyphenyl)-N-(4-methoxyphenyl)methanimine (PubChem CID 961637) has the molecular formula C15H15NO2
and a molecular weight of 241.29 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-N-(4-methoxyphenyl)methanimine.
Molecular Properties
| Compound Name | 1-(2-methoxyphenyl)-N-(4-methoxyphenyl)methanimine |
| PubChem CID | 961637 |
| Molecular Formula | C15H15NO2 |
| Molecular Weight | 241.29 g/mol |
| Exact Mass | 241.11 |
| IUPAC Name | 1-(2-methoxyphenyl)-N-(4-methoxyphenyl)methanimine |
| SMILES | COc1ccc(/N=C/c2ccccc2OC)cc1 |
| InChI | InChI=1S/C15H15NO2/c1-17-14-9-7-13(8-10-14)16-11-12-5-3-4-6-15(12)18-2/h3-11H,1-2H3/b16-11+ |
| InChIKey | UTQHBQZEUVEREK-LFIBNONCSA-N |
| XLogP | 3.45 |
| TPSA | 30.82 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 241.29 |
| LogP ≤ 5 | 3.45 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'imine_1', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 1-(2-methoxyphenyl)-N-(4-methoxyphenyl)methanimine?
The IUPAC name of 1-(2-methoxyphenyl)-N-(4-methoxyphenyl)methanimine (CID 961637) is 1-(2-methoxyphenyl)-N-(4-methoxyphenyl)methanimine.
What is the SMILES notation for 1-(2-methoxyphenyl)-N-(4-methoxyphenyl)methanimine?
The canonical SMILES for 1-(2-methoxyphenyl)-N-(4-methoxyphenyl)methanimine is COc1ccc(/N=C/c2ccccc2OC)cc1.
What is the InChIKey of 1-(2-methoxyphenyl)-N-(4-methoxyphenyl)methanimine?
The InChIKey is UTQHBQZEUVEREK-LFIBNONCSA-N. The full InChI is InChI=1S/C15H15NO2/c1-17-14-9-7-13(8-10-14)16-11-12-5-3-4-6-15(12)18-2/h3-11H,1-2H3/b16-11+.
What are the key properties of 1-(2-methoxyphenyl)-N-(4-methoxyphenyl)methanimine?
1-(2-methoxyphenyl)-N-(4-methoxyphenyl)methanimine has a molecular weight of 241.29 g/mol, XLogP of 3.45, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-N-(4-methoxyphenyl)methanimine is sourced from PubChem (CID 961637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).