(2S)-2-Amino-1-[(2S,5R)-2-(Aminomethyl)-5-Ethynyl-1-Pyrrolidinyl]-2-Cyclopentylethanone

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Formula C14H23N3O
IUPAC Name (2s)-2-amino-1-[(2s,5r)-2-(aminomethyl)-5-ethynyl-pyrrolidin-1-yl]-2-cyclopentyl-ethanone
Molecular Mass 249.352 g·mol−1
Heat of Formation -2.8 ± 16.7 kJ·mol−1
Dipole Moment 2.61 ± 1.08 D
Volume 289.51 Å 3
Surface Area 240.13 Å 2
HOMO Energy -9.35 ± 0.55 eV
LUMO Energy 3.80 ± eV
Point Group Symmetry C1
Synonyms
  • (1s)-2-[(2s,5r)-2-(aminomethyl)-5-ethynylpyrrolidin-1-yl]-1-cyclopentyl-2-oxoethanamine
  • (2s)-2-amino-1-[(2s,5r)-2-(aminomethyl)-5-ethynyl-pyrrolidin-1-yl]-2-cyclopentyl-ethanone
InChIKey XYVMJMYCUZCIPB-AVGNSLFASA-N
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