Biological Magnetic Resonance Data Bank

A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
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N_methylurea synonyms

N-Methylurea; urea, N-methyl-; Monomethylurea; Methylurea; 1-Methylurea


Graphical representations:


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Molecular Formula: C2H6N2O

Natural Isotopic Abundance Mass: 74.08184

Mono-Isotopic Molecular Masses:

  • C12N14: 74.0480128251
  • C13N14: 76.0547225007
  • C12N15: 76.0420826115
  • C13N15: 78.0487922871

InChI string: InChI=1S/C2H6N2O/c1-4-2(3)5/h1H3,(H3,3,4,5)

PubChem Compound (CID): 11719
CAS Registry number: 598-50-5
NMRShiftDB: 20025572
KEGG Compound ID: C16363
UM-BBD: c1176
MMCD: cq_014627
MDL: MFCD00007950
PDB Compound ID: NMU

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.

InChI string and atom numbering calculated using ALATIS (Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia, "Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017), doi:10.1038/sdata.2017.73,