N-[rel-(3R,4S)-1-(but-2-ynoyl)-4-(hydroxymethyl)pyrrolidin-3-yl]cyclobutanecarboxamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-1-(but-2-ynoyl)-4-(hydroxymethyl)pyrrolidin-3-yl]cyclobutanecarboxamide
N-[rel-(3R,4S)-1-(but-2-ynoyl)-4-(hydroxymethyl)pyrrolidin-3-yl]cyclobutanecarboxamide
Compound characteristics
| Compound ID: | T003-0252 |
| Compound Name: | N-[rel-(3R,4S)-1-(but-2-ynoyl)-4-(hydroxymethyl)pyrrolidin-3-yl]cyclobutanecarboxamide |
| Molecular Weight: | 264.32 |
| Molecular Formula: | C14 H20 N2 O3 |
| Smiles: | CC#CC(N1C[C@H]([C@@H](C1)CO)NC(C1CCC1)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.4552 |
| logD: | -0.4552 |
| logSw: | -0.7092 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.839 |
| InChI Key: | XMRXSQOTARINMY-NWDGAFQWSA-N |