Basic information
- CAS
25517-07-1- Standard SMILES
C[N+]1(CC(=O)NC23CC4CC(CC(C4)C2)C3)CCCCC1.[I-]- InChIKey
RMNHATXITZKMLK-UHFFFAOYSA-N- Molecular formula
- C18H31IN2O
- Average molar mass
- 418.4 g/mol
- Monoisotopic mass
- 418.14811
Names & identifiers
- Preferred name
- N-(Adamantan-1-yl)-2-(1-methylpiperidin-1-ium-1-yl)ethanimidate--hydrogen iodide (1/1)
- IUPAC
- N-(1-adamantyl)-2-(1-methylpiperidin-1-ium-1-yl)acetamide iodide
Names & synonyms
25517-07-1DTXSID30948406N-(Adamantan-1-yl)-2-(1-methylpiperidin-1-ium-1-yl)ethanimidate--hydrogen iodide (1/1)RefChem:1091385DTXCID901376637T 22341-((1-Adamantylcarbamoyl)methyl)-1-methylpiperidinium iodidePiperidinium, 1-((1-adamantylcarbamoyl)methyl)-1-methyl-, iodide
Database identifiers
- CAS
25517-07-1- PubChem CID
- 64209
Properties
Computed structural properties
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 384
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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