1-{2-[(pyrrolidin-1-yl)methyl]piperidin-1-yl}but-2-yn-1-one
Chemical Structure Depiction of
1-{2-[(pyrrolidin-1-yl)methyl]piperidin-1-yl}but-2-yn-1-one
1-{2-[(pyrrolidin-1-yl)methyl]piperidin-1-yl}but-2-yn-1-one
Compound characteristics
| Compound ID: | T001-1366 |
| Compound Name: | 1-{2-[(pyrrolidin-1-yl)methyl]piperidin-1-yl}but-2-yn-1-one |
| Molecular Weight: | 234.34 |
| Molecular Formula: | C14 H22 N2 O |
| Smiles: | CC#CC(N1CCCCC1CN1CCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7224 |
| logD: | 0.9856 |
| logSw: | -1.647 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 20.3757 |
| InChI Key: | VCQFPWJJWIWJHG-CYBMUJFWSA-N |