Piperazine, 4-(1-adamantylmethyl)-1-benzyl-
Basic information
- CAS
101975-79-5- Standard SMILES
c1ccc(CN2CCN(CC34CC5CC(CC(C5)C3)C4)CC2)cc1- InChIKey
NYEMJQQTKVPBHB-UHFFFAOYSA-N- Molecular formula
- C22H32N2
- Average molar mass
- 324.5 g/mol
- Monoisotopic mass
- 324.25654903
Names & identifiers
- Preferred name
- Piperazine, 4-(1-adamantylmethyl)-1-benzyl-
- IUPAC
- 1-(1-adamantylmethyl)-4-benzylpiperazine
Names & synonyms
Piperazine, 4-(1-adamantylmethyl)-1-benzyl-N'-(1-Adamantylmethyl)-N-benzylpiperazine101975-79-5DTXSID10144449RefChem:372644DTXCID10669401-[(Adamantan-1-yl)methyl]-4-benzylpiperazine
Database identifiers
- CAS
101975-79-5- PubChem CID
- 64559
- DTXSID
DTXSID10144449- Nikkaji
- J107.199H
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 6.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 390
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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