(2S)-2-Amino-4-[(4-Chlorobenzyl)Amino]-1-(1-Piperidinyl)-1-Butanone

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Properties Simple | Detailed

Formula C16H24ClN3O
IUPAC Name (2s)-2-amino-4-[(4-chlorophenyl)methylamino]-1-(1-piperidyl)butan-1-one
Molecular Mass 309.834 g·mol−1
Heat of Formation -184.0 ± 16.7 kJ·mol−1
Dipole Moment 2.19 ± 1.08 D
Volume 387.86 Å 3
Surface Area 318.88 Å 2
HOMO Energy -9.07 ± 0.55 eV
LUMO Energy 2.61 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-amino-4-[(4-chlorobenzyl)amino]-1-piperidino-butan-1-one
  • (2s)-2-amino-4-[(4-chlorophenyl)methylamino]-1-(1-piperidyl)butan-1-one
  • (2s)-2-amino-4-[(4-chlorophenyl)methylamino]-1-piperidin-1-yl-butan-1-one
  • (2s)-2-amino-4-[(4-chlorophenyl)methylamino]-1-piperidin-1-ylbutan-1-one
InChIKey DNVZYSMOLXCOLY-HNNXBMFYSA-N
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Elements H C N O Cl