Basic information
- CAS
38789-56-9- Standard SMILES
CC(C)N1CCN(C23CC4CC(CC(C4)C2)C3)CC1.Cl.Cl- InChIKey
CQZICWJWXPTLQH-UHFFFAOYSA-N- Molecular formula
- C17H32Cl2N2
- Average molar mass
- 335.4 g/mol
- Monoisotopic mass
- 334.1942544
Names & identifiers
- Preferred name
- Piperazine, 1-(1-adamantyl)-4-isopropyl-, dihydrochloride
- IUPAC
- 1-(1-adamantyl)-4-propan-2-ylpiperazine;dihydrochloride
Names & synonyms
Piperazine, 1-(1-adamantyl)-4-isopropyl-, dihydrochloride1-(1-Adamantyl)-4-isopropylpiperazine dihydrochloride38789-56-9Adamantane, 1-(1-(4-isopropyl)piperazinyl)-, dihydrochlorideDTXSID00192055RefChem:371864DTXCID101145461-(Adamantan-1-yl)-4-(propan-2-yl)piperazine--hydrogen chloride (1/2)
Database identifiers
- CAS
38789-56-9- PubChem CID
- 64329
- DTXSID
DTXSID00192055
Properties
Computed structural properties
- Topological polar surface area
- 6.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 300
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…