prop-2-yn-1-yl 5-(3-methylanilino)-5-oxopentanoate
Chemical Structure Depiction of
prop-2-yn-1-yl 5-(3-methylanilino)-5-oxopentanoate
prop-2-yn-1-yl 5-(3-methylanilino)-5-oxopentanoate
Compound characteristics
| Compound ID: | 8010-4203 |
| Compound Name: | prop-2-yn-1-yl 5-(3-methylanilino)-5-oxopentanoate |
| Molecular Weight: | 259.3 |
| Molecular Formula: | C15 H17 N O3 |
| Smiles: | Cc1cccc(c1)NC(CCCC(=O)OCC#C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2099 |
| logD: | 2.2099 |
| logSw: | -2.7859 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.841 |
| InChI Key: | HETJGJFUMGOCFV-UHFFFAOYSA-N |