About (E)-N-(1-methoxyethyl)-1-(4-methoxyphenyl)methanimine
(E)-N-(1-methoxyethyl)-1-(4-methoxyphenyl)methanimine (PubChem CID 10465201) has the molecular formula C11H15NO2
and a molecular weight of 193.25 g/mol. Its IUPAC name is (E)-N-(1-methoxyethyl)-1-(4-methoxyphenyl)methanimine.
Molecular Properties
| Compound Name | (E)-N-(1-methoxyethyl)-1-(4-methoxyphenyl)methanimine |
| PubChem CID | 10465201 |
| Molecular Formula | C11H15NO2 |
| Molecular Weight | 193.25 g/mol |
| Exact Mass | 193.11 |
| IUPAC Name | (E)-N-(1-methoxyethyl)-1-(4-methoxyphenyl)methanimine |
| SMILES | COc1ccc(/C=N/C(C)OC)cc1 |
| InChI | InChI=1S/C11H15NO2/c1-9(13-2)12-8-10-4-6-11(14-3)7-5-10/h4-9H,1-3H3/b12-8+ |
| InChIKey | FICXNKKIFCFIRG-XYOKQWHBSA-N |
| XLogP | 2.11 |
| TPSA | 30.82 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 193.25 |
| LogP ≤ 5 | 2.11 |
| 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 (E)-N-(1-methoxyethyl)-1-(4-methoxyphenyl)methanimine?
The IUPAC name of (E)-N-(1-methoxyethyl)-1-(4-methoxyphenyl)methanimine (CID 10465201) is (E)-N-(1-methoxyethyl)-1-(4-methoxyphenyl)methanimine.
What is the SMILES notation for (E)-N-(1-methoxyethyl)-1-(4-methoxyphenyl)methanimine?
The canonical SMILES for (E)-N-(1-methoxyethyl)-1-(4-methoxyphenyl)methanimine is COc1ccc(/C=N/C(C)OC)cc1.
What is the InChIKey of (E)-N-(1-methoxyethyl)-1-(4-methoxyphenyl)methanimine?
The InChIKey is FICXNKKIFCFIRG-XYOKQWHBSA-N. The full InChI is InChI=1S/C11H15NO2/c1-9(13-2)12-8-10-4-6-11(14-3)7-5-10/h4-9H,1-3H3/b12-8+.
What are the key properties of (E)-N-(1-methoxyethyl)-1-(4-methoxyphenyl)methanimine?
(E)-N-(1-methoxyethyl)-1-(4-methoxyphenyl)methanimine has a molecular weight of 193.25 g/mol, XLogP of 2.11, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-(1-methoxyethyl)-1-(4-methoxyphenyl)methanimine is sourced from PubChem (CID 10465201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).