Adamantane, 1-(2-methylaminopropyl)-3,5,7-trimethyl-, hydrochloride

HCID 35971

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Basic information

CAS: 31897-79-7
Standard SMILES: CNC(C)CC12CC3(C)CC(C)(CC(C)(C3)C1)C2.Cl
InChIKey: CZJHALUOIGDGOP-UHFFFAOYSA-N
Molecular formula: C17H32ClN
Average molar mass: 285.9 g/mol
Monoisotopic mass: 285.2223277

Names & identifiers

Preferred name: Adamantane, 1-(2-methylaminopropyl)-3,5,7-trimethyl-, hydrochloride
IUPAC: N-methyl-1-(3,5,7-trimethyl-1-adamantyl)propan-2-amine;hydrochloride

Names & synonyms

ADAMANTANE, 1-(2-METHYLAMINOPROPYL)-3,5,7-TRIMETHYL-, HYDROCHLORIDE31897-79-7RefChem:10761672-Propylamine, N-methyl-1-(3,5,7-trimethyl-1-adamantyl)-, hydrochlorideDTXSID60953801N-Methyl-1-(3,5,7-trimethyladamantan-1-yl)propan-2-amine--hydrogen chloride (1/1)

Database identifiers

CAS: 31897-79-7
PubChem CID: 35971
DTXSID: DTXSID60953801

Properties

Computed structural properties

Topological polar surface area: 12 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 1
Rotatable bonds: 3
Heavy atoms: 19
Formal charge: 0
Complexity: 299

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