Basic information
- CAS
23309-10-6- Standard SMILES
C[N+]1(CCN(c2ccccc2)C2CCCCC2)CCCCC1- InChIKey
XNYZRYYRXQSIGD-UHFFFAOYSA-N- Molecular formula
- C20H33N2+
- Average molar mass
- 301.5 g/mol
- Monoisotopic mass
- 301.26437406
Names & identifiers
- Preferred name
- 1-[2-(Cyclohexylphenylamino)ethyl]-1-methylpiperidinium
- IUPAC
- N-cyclohexyl-N-[2-(1-methylpiperidin-1-ium-1-yl)ethyl]aniline
Names & synonyms
1-[2-(Cyclohexylphenylamino)ethyl]-1-methylpiperidiniumDTXSID90120720823309-10-61-{2-[Cyclohexyl(phenyl)amino]ethyl}-1-methylpiperidin-1-ium
Database identifiers
- CAS
23309-10-6- PubChem CID
- 199495
- DTXSID
DTXSID901207208
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 1
- Complexity
- 310
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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