Coniine
Representations & DB's id
| ||
| ChEBI: | CHEBI:28322 | |
|---|---|---|
| ChEMBL: | CHEMBL2287063 | |
| PubChem: | 441072 | |
| IUPAC: | (2S)-2-propylpiperidine | |
| Standard InChI: | InChI=1S/C8H17N/c1-2-5-8-6-3-4-7-9-8/h8-9H,2-7H2,1H3/t8-/m0/s1 | |
| Standard InChI Key: | NDNUANOUGZGEPO-QMMMGPOBSA-N | |
| SMILES: | CCC[C@H]1CCCCN1 | |
Molecular propeties
| ||
| AlogP: | 1.93 | |
|---|---|---|
| Hydrogen bonds acceptors: | 1 | |
| Hydrogen bonds donors: | 1 | |
| Rotatable bonds: | 2 | |
| Number of rings: | 1 | |
| Molecular Weight: | 127.14 | |
| Topological polar surface area: | 12 | |
| Number of aromatic rings: | 0 | |
| Fsp3: | 1 | |
| Number of carbons: | 8 | |
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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