Basic information
- CAS
25517-12-8- Standard SMILES
C[N+]1(CC(=O)NC23CC4CC(CC(C4)C2)C3)CCOCC1.[I-]- InChIKey
IZHQMAJJQHAJBD-UHFFFAOYSA-N- Molecular formula
- C17H29IN2O2
- Average molar mass
- 420.3 g/mol
- Monoisotopic mass
- 420.12738
Names & identifiers
- Preferred name
- Morpholinium, ((1-adamantylcarbamoyl)methyl)-4-methyl-, iodide
- IUPAC
- N-(1-adamantyl)-2-(4-methylmorpholin-4-ium-4-yl)acetamide iodide
Names & synonyms
Morpholinium, ((1-adamantylcarbamoyl)methyl)-4-methyl-, iodide25517-12-8RefChem:1090007T 2242((1-Adamantylcarbamoyl)methyl)-4-methylmorpholinium iodide
Database identifiers
- CAS
25517-12-8- PubChem CID
- 64217
Properties
Computed structural properties
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 387
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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