Cas no 69251-45-2 (2-amino-5-(aminomethyl)-3,7-dihydro-4H-Pyrrolo[2,3-d]pyrimidin-4-one)

2-amino-5-(aminomethyl)-3,7-dihydro-4H-Pyrrolo[2,3-d]pyrimidin-4-one structure
69251-45-2 structure
Product Name:2-amino-5-(aminomethyl)-3,7-dihydro-4H-Pyrrolo[2,3-d]pyrimidin-4-one
CAS No:69251-45-2
MF:C7H9N5O
MW:179.179260015488
CID:392006
PubChem ID:135398563
Update Time:2025-04-19

2-amino-5-(aminomethyl)-3,7-dihydro-4H-Pyrrolo[2,3-d]pyrimidin-4-one Chemical and Physical Properties

Names and Identifiers

    • 2-amino-5-(aminomethyl)-3,7-dihydro-4H-Pyrrolo[2,3-d]pyrimidin-4-one
    • 2-amino-5-(aminomethyl)-1H,4H,7H-pyrrolo[2,3-d]pyrimidin-4-one
    • SCHEMBL20206657
    • 2-Amino-5-(aminomethyl)-3H-pyrrolo[2,3-d]pyrimidin-4(7H)-one
    • PD039191
    • NS00069406
    • 2-amino-5-(aminomethyl)-3,7-dihydropyrrolo[2,3-d]pyrimidin-4-one
    • 2-amino-5-(aminomethyl)-1,7-dihydro-4h-pyrrolo[2,3-d]pyrimidin-4-one
    • 2-amino-5-(aminomethyl)-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-4-one
    • SCHEMBL166747
    • 7-DEAZA-7-AMINOMETHYL-GUANINE
    • DTXSID301343549
    • DB03304
    • CHEBI:45126
    • 7-Aminomethyl-7-carbaguanine
    • 2-amino-5-(aminomethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-ol
    • CHEMBL1235432
    • Q27120591
    • CID 5289204
    • preQ1
    • 69251-45-2
    • 7-aminomethyl-7-deazaguanine
    • Inchi: 1S/C7H9N5O/c8-1-3-2-10-5-4(3)6(13)12-7(9)11-5/h2H,1,8H2,(H4,9,10,11,12,13)
    • InChI Key: MEYMBLGOKYDGLZ-UHFFFAOYSA-N
    • SMILES: O=C1C2=C(N=C(N)N1)NC=C2CN

Computed Properties

  • Exact Mass: 179.08087
  • Monoisotopic Mass: 179.08070993g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 264
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -1.9
  • Topological Polar Surface Area: 109?2

Experimental Properties

  • PSA: 109.29

2-amino-5-(aminomethyl)-3,7-dihydro-4H-Pyrrolo[2,3-d]pyrimidin-4-one Related Literature

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