2,5-Methanoindan-4-amine, hexahydro-N-2-hydroxyethyl-, hydrochloride

HCID 64403

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Basic information

CAS: 59177-73-0
Standard SMILES: Cl.OCCNC1C2CCC3CC(C2)CC31
InChIKey: BVBFNIXOVOLXMT-UHFFFAOYSA-N
Molecular formula: C12H22ClNO
Average molar mass: 231.76 g/mol
Monoisotopic mass: 231.138992

Names & identifiers

Preferred name: 2,5-Methanoindan-4-amine, hexahydro-N-2-hydroxyethyl-, hydrochloride
IUPAC: 2-(7-tricyclo[4.3.1.03,8]decanylamino)ethanol;hydrochloride

Names & synonyms

N-(2-Hydroxyethyl)-4-protoadamantaneamine hydrochloride2,5-Methanoindan-4-amine, hexahydro-N-2-hydroxyethyl-, hydrochloride59177-73-0Ethanol, 2-((octahydro-2,5-methano-1H-inden-4-yl)amino)-, hydrochlorideRefChem:247727DTXSID409746102-[(Octahydro-1H-2,5-methanoinden-4-yl)amino]ethan-1-ol--hydrogen chloride (1/1)

Database identifiers

CAS: 59177-73-0
PubChem CID: 64403
DTXSID: DTXSID40974610

Properties

Computed structural properties

Topological polar surface area: 32.3 Å²
Hydrogen bond donors: 3
Hydrogen bond acceptors: 2
Rotatable bonds: 3
Heavy atoms: 15
Formal charge: 0
Complexity: 218

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