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CAS 71581-93-6

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(1S,2R)-2-[(Phenylmethyl)amino]cyclohexanemethanol

Description:
(1S,2R)-2-[(Phenylmethyl)amino]cyclohexanemethanol, with CAS number 71581-93-6, is a chemical compound characterized by its chiral structure, which includes a cyclohexane ring substituted with both a phenylmethylamino group and a hydroxymethyl group. This compound exhibits stereochemistry, indicated by the (1S,2R) configuration, which plays a crucial role in its biological activity and interactions. The presence of the amino group suggests potential for hydrogen bonding, influencing its solubility and reactivity. Additionally, the phenylmethyl group contributes to the compound's lipophilicity, which may affect its pharmacokinetic properties. The hydroxymethyl group can also participate in hydrogen bonding, enhancing its potential for interactions with biological targets. Overall, this compound may be of interest in medicinal chemistry, particularly in the development of pharmaceuticals, due to its structural features that could influence its efficacy and safety profiles. Further studies would be necessary to fully elucidate its properties and potential applications.
Formula:C14H21NO
InChI:InChI=1S/C14H21NO/c16-11-13-8-4-5-9-14(13)15-10-12-6-2-1-3-7-12/h1-3,6-7,13-16H,4-5,8-11H2/t13-,14-/m1/s1
InChI key:InChIKey=BRQFIORUNWWNBM-ZIAGYGMSSA-N
SMILES:N(CC1=CC=CC=C1)[C@H]2[C@@H](CO)CCCC2
Synonyms:
  • (-)-cis-2-Benzylaminocyclohexanemethanol
  • (1R,2S)-N-benzyl-2-(hydroxymethyl)cyclohexanaminium
  • (1S,2R)-2-[(Phenylmethyl)amino]cyclohexanemethanol
  • Cyclohexanemethanol, 2-[(phenylmethyl)amino]-, (1S,2R)-
  • Cyclohexanemethanol, 2-[(phenylmethyl)amino]-, (1S-cis)-
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