1,1-Dimethyl-2-propylpiperidin-1-ium
PubChem CID: 5316883
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| Compound Synonyms | SCHEMBL19114204 |
|---|---|
| Topological Polar Surface Area | 0.0 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 11.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 118.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 1,1-dimethyl-2-propylpiperidin-1-ium |
| Prediction Hob | 1.0 |
| Xlogp | 2.4 |
| Molecular Formula | C10H22N+ |
| Prediction Swissadme | 0.0 |
| Inchi Key | DUMHGORTMDIJNA-UHFFFAOYSA-N |
| Fcsp3 | 1.0 |
| Logs | 0.385 |
| Rotatable Bond Count | 2.0 |
| Logd | -0.964 |
| Compound Name | 1,1-Dimethyl-2-propylpiperidin-1-ium |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 156.175 |
| Formal Charge | 1.0 |
| Monoisotopic Mass | 156.175 |
| Hydrogen Bond Acceptor Count | 0.0 |
| Molecular Weight | 156.29 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 1.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -2.2142166 |
| Inchi | InChI=1S/C10H22N/c1-4-7-10-8-5-6-9-11(10,2)3/h10H,4-9H2,1-3H3/q+1 |
| Smiles | CCCC1CCCC[N+]1(C)C |
| Nring | 1.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Gynostemma Pentaphyllum (Plant) Rel Props:Source_db:cmaup_ingredients