N-Methyl-3-(2-phenyladamantan-1-yl)propan-1-amine--hydrogen chloride (1/1)
Basic information
- CAS
52583-03-6- Standard SMILES
CNCCCC12CC3CC(CC(C3)C1c1ccccc1)C2.Cl- InChIKey
DDRGWEZDDZXEBZ-UHFFFAOYSA-N- Molecular formula
- C20H30ClN
- Average molar mass
- 319.9 g/mol
- Monoisotopic mass
- 319.2066777
Names & identifiers
- Preferred name
- N-Methyl-3-(2-phenyladamantan-1-yl)propan-1-amine--hydrogen chloride (1/1)
- IUPAC
- N-methyl-3-(2-phenyl-1-adamantyl)propan-1-amine;hydrochloride
Names & synonyms
52583-03-6DTXSID50967013N-Methyl-3-(2-phenyladamantan-1-yl)propan-1-amine--hydrogen chloride (1/1)RefChem:1091886DTXCID301394623ADAMANTANE, 1-(3-METHYLAMINOPROPYL)-2-PHENYL-, HYDROCHLORIDEPropylamine, N-methyl-3-(2-phenyl-1-adamantyl)-, hydrochloride
Database identifiers
- CAS
52583-03-6- PubChem CID
- 40444
- DTXSID
DTXSID50967013
Properties
Computed structural properties
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 343
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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