Rimantadine | SBID = 1509 | Compound |
Structure
Molecular Properties
| Interactions: | 1 | ||
| PubChem TPSA/Å2: | 26.0 | ||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | 2.6 | ||
| Hydrophilicity (Cheng XLogP3): | |||
| Charge: | 0.0 | ||
| Number of H-Bond Donors: | 1.0 | ||
| Number of H-Bond Acceptors: | 1.0 | ||
| Number of Stereogenic Bonds (E/Z): | 0.0 | ||
| Number of Stereogenic Atoms (R/S): | 1.0 | ||
| 3D Volume/Å3: | 138.9 | ||
| Sum Formula: | C12H21N | ||
| M / g/mol: | 179.3 | ||
| Complexity: | 180.0 | ||
| Number of Conformers: | 1.0 |
Identifiers
- Tags: drug
- Name: Rimantadine
- Preferred Abbreviation: rimantadine
- IUPAC Name: 1-(1-adamantyl)ethanamine
- CAS: 13392-28-4
- CID: 5071
- InChiKey: UBCHPRBFMUDMNC-UHFFFAOYSA-N
- InChi: InChI=1S/C12H21N/c1-8(13)12-5-9-2-10(6-12)4-11(3-9)7-12/h8-11H,2-7,13H2,1H3
- CanoSmiles: CC(C12CC3CC(C1)CC(C3)C2)N
- IsoSmiles: CC(C12CC3CC(C1)CC(C3)C2)N
