1-Adamantaneacetamide, N-(3-(diethylamino)propyl)-, ethyl iodide

HCID 64384

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Basic information

CAS: 54099-16-0
Standard SMILES: CCI.CCN(CC)CCCNC(=O)CC12CC3CC(CC(C3)C1)C2
InChIKey: UMRCHYLDMXVONG-UHFFFAOYSA-N
Molecular formula: C21H39IN2O
Average molar mass: 462.5 g/mol
Monoisotopic mass: 462.21071

Names & identifiers

Preferred name: 1-Adamantaneacetamide, N-(3-(diethylamino)propyl)-, ethyl iodide
IUPAC: 2-(1-adamantyl)-N-[3-(diethylamino)propyl]acetamide;iodoethane

Names & synonyms

N-(3-(Diethylamino)propyl)-1-adamantaneacetamide ethyl iodide54099-16-01-Adamantaneacetamide, N-(3-(diethylamino)propyl)-, ethyl iodideDTXSID10202437RefChem:227374DTXCID101249282-(Adamantan-1-yl)-N-[3-(diethylamino)propyl]acetamide--iodoethane (1/1)

Database identifiers

CAS: 54099-16-0
PubChem CID: 64384
DTXSID: DTXSID10202437

Properties

Computed structural properties

Topological polar surface area: 32.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 8
Heavy atoms: 25
Formal charge: 0
Complexity: 350

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