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

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Properties Simple | Detailed

Formula C15H25N3O
IUPAC Name (2s)-2-amino-1-[(2s,5r)-2-(aminomethyl)-5-prop-1-ynyl-pyrrolidin-1-yl]-2-cyclopentyl-ethanone
Molecular Mass 263.378 g·mol−1
Heat of Formation -73.0 ± 16.7 kJ·mol−1
Dipole Moment 4.51 ± 1.08 D
Volume 353.89 Å 3
Surface Area 290.61 Å 2
HOMO Energy -8.96 ± 0.55 eV
LUMO Energy 3.87 ± eV
Point Group Symmetry C1
Synonyms
  • (1s)-2-[(2s,5r)-2-(aminomethyl)-5-(prop-1-yn-1-yl)pyrrolidin-1-yl]-1-cyclopentyl-2-oxoethanamine
  • (1s)-2-[(2s,5r)-2-(aminomethyl)-5-prop-1-yn-1-ylpyrrolidin-1-yl]-1-cyclopentyl-2-oxoethanamine
  • (2s)-2-amino-1-[(2s,5r)-2-(aminomethyl)-5-prop-1-ynyl-1-pyrrolidinyl]-2-cyclopentylethanone
  • (2s)-2-amino-1-[(2s,5r)-2-(aminomethyl)-5-prop-1-ynyl-pyrrolidin-1-yl]-2-cyclopentyl-ethanone
  • (2s)-2-amino-1-[(2s,5r)-2-(aminomethyl)-5-prop-1-ynylpyrrolidin-1-yl]-2-cyclopentylethanone
InChIKey RIKCMKYTGBHVSX-IHRRRGAJSA-N
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