3-butanoyl-4-[(2-hydroxyethyl)amino]-6-methyl-2H-pyran-2-one
Chemical Structure Depiction of
3-butanoyl-4-[(2-hydroxyethyl)amino]-6-methyl-2H-pyran-2-one
3-butanoyl-4-[(2-hydroxyethyl)amino]-6-methyl-2H-pyran-2-one
Compound characteristics
| Compound ID: | 8016-8486 |
| Compound Name: | 3-butanoyl-4-[(2-hydroxyethyl)amino]-6-methyl-2H-pyran-2-one |
| Molecular Weight: | 239.27 |
| Molecular Formula: | C12 H17 N O4 |
| Smiles: | CCCC(C1=C(C=C(C)OC1=O)NCCO)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8009 |
| logD: | 0.8008 |
| logSw: | -0.9913 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.024 |
| InChI Key: | YWADNMINTJXLEI-UHFFFAOYSA-N |