Basic information
- CAS
25517-23-1- Standard SMILES
C[N+]1(CCC(=O)NC23CC4CC(CC(C4)C2)C3)CCOCC1.[I-]- InChIKey
FCQNYFMOJDVYIO-UHFFFAOYSA-N- Molecular formula
- C18H31IN2O2
- Average molar mass
- 434.4 g/mol
- Monoisotopic mass
- 434.14303
Names & identifiers
- Preferred name
- Morpholinium, 4-(2-(1-adamantylcarbamoyl)ethyl)-4-methyl-, iodide
- IUPAC
- N-(1-adamantyl)-3-(4-methylmorpholin-4-ium-4-yl)propanamide iodide
Names & synonyms
Morpholinium, 4-(2-(1-adamantylcarbamoyl)ethyl)-4-methyl-, iodide25517-23-1RefChem:1090020T 22554-(2-(1-Adamantylcarbamoyl)ethyl)-4-methylmorpholinium iodide
Database identifiers
- CAS
25517-23-1- PubChem CID
- 64235
Properties
Computed structural properties
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 401
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…