2-Amino-N-(3-Aminopropyl)-4-Oxo-4,7-Dihydro-1H-Pyrrolo[2,3-D]Pyrimidine-5-Carboxamide

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Properties Simple | Detailed

Formula C10H14N6O2
IUPAC Name 2-amino-n-(3-aminopropyl)-4-oxo-1,7-dihydropyrrolo[4,5-e]pyrimidine-5-carboxamide
Molecular Mass 250.257 g·mol−1
Heat of Formation 1497.4 ± 16.7 kJ·mol−1
Dipole Moment 5.88 ± 1.08 D
Volume 251.39 Å 3
Surface Area 234.47 Å 2
HOMO Energy -10.06 ± 0.55 eV
LUMO Energy -4.56 ± eV
Point Group Symmetry C1
Synonyms
  • 1h-pyrrolo(2,3-d)pyrimidine-5-carboxamide, 2-amino-n-(3-aminopropyl)-4,7-dihydro-4-oxo-
  • 2-amino-n-(3-aminopropyl)-4-keto-1,7-dihydropyrrolo[4,5-e]pyrimidine-5-carboxamide
  • 2-amino-n-(3-aminopropyl)-4-oxo-1,7-dihydropyrrolo[4,5-e]pyrimidine-5-carboxamide
  • echiguanine b
  • n-(3-aminopropyl)-2-amino-4-hydroxy-7h-pyrrolo(2,3-d)pyrimidine-5-carboxamide
CAS Number(s)
  • 137319-26-7
InChIKey VJLKKBXETQVDAL-UHFFFAOYSA-N
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