(7R)-4,7-dimethyl-6,7-dihydro-5H-cyclopenta[c]pyridine
PubChem CID: 9812811
Connections displayed (default: 10).
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| Compound Synonyms | SCHEMBL21803724 |
|---|---|
| Topological Polar Surface Area | 12.9 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 11.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 144.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 1.0 |
| Iupac Name | (7R)-4,7-dimethyl-6,7-dihydro-5H-cyclopenta[c]pyridine |
| Prediction Hob | 1.0 |
| Xlogp | 2.4 |
| Molecular Formula | C10H13N |
| Prediction Swissadme | 0.0 |
| Inchi Key | ZHQQRIUYLMXDPP-SSDOTTSWSA-N |
| Fcsp3 | 0.5 |
| Logs | -1.753 |
| Rotatable Bond Count | 0.0 |
| Logd | 1.972 |
| Compound Name | (7R)-4,7-dimethyl-6,7-dihydro-5H-cyclopenta[c]pyridine |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 147.105 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 147.105 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 147.22 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 1.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -2.655806563636364 |
| Inchi | InChI=1S/C10H13N/c1-7-3-4-9-8(2)5-11-6-10(7)9/h5-7H,3-4H2,1-2H3/t7-/m1/s1 |
| Smiles | C[C@@H]1CCC2=C1C=NC=C2C |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Actinidia Arguta (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Actinidia Chinensis (Plant) Rel Props:Source_db:cmaup_ingredients - 3. Outgoing r'ship
FOUND_INto/from Actinidia Polygama (Plant) Rel Props:Source_db:cmaup_ingredients - 4. Outgoing r'ship
FOUND_INto/from Tecoma Stans (Plant) Rel Props:Source_db:cmaup_ingredients - 5. Outgoing r'ship
FOUND_INto/from Valeriana Officinalis (Plant) Rel Props:Source_db:cmaup_ingredients