1-methyl-1-{2-[3-(4-methylphenyl)propoxy]-2-oxoethyl}pyrrolidin-1-ium--iodide (1/1)
Chemical Structure Depiction of
1-methyl-1-{2-[3-(4-methylphenyl)propoxy]-2-oxoethyl}pyrrolidin-1-ium--iodide (1/1)
1-methyl-1-{2-[3-(4-methylphenyl)propoxy]-2-oxoethyl}pyrrolidin-1-ium--iodide (1/1)
Compound characteristics
| Compound ID: | 6228-0487 |
| Compound Name: | 1-methyl-1-{2-[3-(4-methylphenyl)propoxy]-2-oxoethyl}pyrrolidin-1-ium--iodide (1/1) |
| Molecular Weight: | 403.3 |
| Molecular Formula: | C17 H26 N O2 |
| Salt: | I- |
| Smiles: | Cc1ccc(CCCOC(C[N+]2(C)CCCC2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.4238 |
| logD: | 3.4238 |
| logSw: | -3.3785 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 21.4638 |
| InChI Key: | JHJAVMNPWYAYRK-UHFFFAOYSA-N |