HuagongsheHuagongshe Chemistry Print Report · For research reference only
N-(6-n-Propyl-2-vinyl-8alpha-ergolinyl)-formamide
Identifiers & Physical Properties
| Molecular formula | C20H25N3O |
|---|---|
| Average molar mass | 323.4 g/mol |
| Monoisotopic mass | 323.19976243 g/mol |
| SMILES | C=Cc1[nH]c2cccc3c2c1C[C@@H]1[C@@H]3C[C@H](NC=O)CN1CCC |
| InChIKey | SLMQILRRSNEHOM-ZBQZNYHESA-N |
| PubChem CID | 15069964 |
Chemical & Physical Properties
| XLogP | 3.5 |
|---|---|
| Topological polar surface area | 48.1 |
| Hydrogen bond donors | 2 |
| Hydrogen bond acceptors | 2 |
| Rotatable bonds | 4 |
| Heavy atoms | 24 |
| Formal charge | 0 |
| Complexity | 482 |