1-aminodiamantane | SBID = 1061 | Compound |
Structure
Molecular Properties
| Interactions: | 4 | ||
| PubChem TPSA/Å2: | 26.0 | ||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | 2.5 | ||
| 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): | 4.0 | ||
| 3D Volume/Å3: | 151.0 | ||
| Sum Formula: | C14H21N | ||
| M / g/mol: | 203.32 | ||
| Complexity: | 312.0 | ||
| Number of Conformers: | 1.0 |
Identifiers
- Tags: typical guest
- Name: 1-aminodiamantane
- Preferred Abbreviation: 1-aminodiamantane
- IUPAC Name: pentacyclo[7.3.1.14,12.02,7.06,11]tetradecan-1-amine
- CAS: 768-94-5
- CID: 15635897
- InChiKey: ISRINZIWHMWKBM-UHFFFAOYSA-N
- InChi: InChI=1S/C14H21N/c15-14-6-8-2-10-9-1-7(4-12(10)14)5-13(14)11(9)3-8/h7-13H,1-6,15H2
- CanoSmiles: C1C2CC3C4C1C5CC(C4)CC3(C5C2)N
- IsoSmiles: C1C2CC3C4C1C5CC(C4)CC3(C5C2)N
