1-{[4-(methoxycarbonyl)phenyl]methyl}-1-methylpiperidin-1-ium--iodide (1/1)
Chemical Structure Depiction of
1-{[4-(methoxycarbonyl)phenyl]methyl}-1-methylpiperidin-1-ium--iodide (1/1)
1-{[4-(methoxycarbonyl)phenyl]methyl}-1-methylpiperidin-1-ium--iodide (1/1)
Compound characteristics
| Compound ID: | 6228-0500 |
| Compound Name: | 1-{[4-(methoxycarbonyl)phenyl]methyl}-1-methylpiperidin-1-ium--iodide (1/1) |
| Molecular Weight: | 375.25 |
| Molecular Formula: | C15 H22 N O2 |
| Salt: | I- |
| Smiles: | C[N+]1(CCCCC1)Cc1ccc(cc1)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.822 |
| logD: | 2.822 |
| logSw: | -2.9405 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 21.8188 |
| InChI Key: | VJADTEWNRGYKDX-UHFFFAOYSA-N |