About (E)-1-(2-methoxyphenyl)-N-[(Z)-(2-methoxyphenyl)methylideneamino]methanimine
(E)-1-(2-methoxyphenyl)-N-[(Z)-(2-methoxyphenyl)methylideneamino]methanimine (PubChem CID 54606181) has the molecular formula C16H16N2O2
and a molecular weight of 268.32 g/mol. Its IUPAC name is (E)-1-(2-methoxyphenyl)-N-[(Z)-(2-methoxyphenyl)methylideneamino]methanimine.
Molecular Properties
| Compound Name | (E)-1-(2-methoxyphenyl)-N-[(Z)-(2-methoxyphenyl)methylideneamino]methanimine |
| PubChem CID | 54606181 |
| Molecular Formula | C16H16N2O2 |
| Molecular Weight | 268.32 g/mol |
| Exact Mass | 268.12 |
| IUPAC Name | (E)-1-(2-methoxyphenyl)-N-[(Z)-(2-methoxyphenyl)methylideneamino]methanimine |
| SMILES | COc1ccccc1/C=N\N=C\c1ccccc1OC |
| InChI | InChI=1S/C16H16N2O2/c1-19-15-9-5-3-7-13(15)11-17-18-12-14-8-4-6-10-16(14)20-2/h3-12H,1-2H3/b17-11-,18-12+ |
| InChIKey | LFZBMHONPSOTMH-MJZABRMRSA-N |
| XLogP | 3.16 |
| TPSA | 43.18 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 268.32 |
| LogP ≤ 5 | 3.16 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 4 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'imine_1', '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 (E)-1-(2-methoxyphenyl)-N-[(Z)-(2-methoxyphenyl)methylideneamino]methanimine?
The IUPAC name of (E)-1-(2-methoxyphenyl)-N-[(Z)-(2-methoxyphenyl)methylideneamino]methanimine (CID 54606181) is (E)-1-(2-methoxyphenyl)-N-[(Z)-(2-methoxyphenyl)methylideneamino]methanimine.
What is the SMILES notation for (E)-1-(2-methoxyphenyl)-N-[(Z)-(2-methoxyphenyl)methylideneamino]methanimine?
The canonical SMILES for (E)-1-(2-methoxyphenyl)-N-[(Z)-(2-methoxyphenyl)methylideneamino]methanimine is COc1ccccc1/C=N\N=C\c1ccccc1OC.
What is the InChIKey of (E)-1-(2-methoxyphenyl)-N-[(Z)-(2-methoxyphenyl)methylideneamino]methanimine?
The InChIKey is LFZBMHONPSOTMH-MJZABRMRSA-N. The full InChI is InChI=1S/C16H16N2O2/c1-19-15-9-5-3-7-13(15)11-17-18-12-14-8-4-6-10-16(14)20-2/h3-12H,1-2H3/b17-11-,18-12+.
What are the key properties of (E)-1-(2-methoxyphenyl)-N-[(Z)-(2-methoxyphenyl)methylideneamino]methanimine?
(E)-1-(2-methoxyphenyl)-N-[(Z)-(2-methoxyphenyl)methylideneamino]methanimine has a molecular weight of 268.32 g/mol, XLogP of 3.16, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-(2-methoxyphenyl)-N-[(Z)-(2-methoxyphenyl)methylideneamino]methanimine is sourced from PubChem (CID 54606181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).