Creatinine

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 1902
Total Number of Articles : 6495
PubChem 588
Molecular Formula

C4H7N3O

SMILES

CN1CC(=O)N=C1N

InChI

InChI=1S/C4H7N3O/c1-7-2-3(8)6-4(7)5/h2H2,1H3,(H2,5,6,8)

synonyms
  • 60-27-5
  • AYI8EX34EU
  • creatinine
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Properties
Property Value
MW 113.12 g/mol
HBD 1
HBA 1
Rotatable Bond Count 0
Exact Mass 113.058911855 g/mol
Monoisotopic Mass 113.058911855 g/mol
Heavy Atom Count 8
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 151
xlogp -1.8
Topological Polar Surface Area 58.7