Metabolomics Structure Database

 
MW REGNO: 54974
Common Name:4-aminopyridine
Systematic Name:pyridin-4-amine
RefMet Name:4-Aminopyridine
Synonyms:4-AP; 4-Aminopyridine; 4-Pyridinamine; 4-Pyridylamine; Avitrol; Dalfampridine; N07XX07; gamma-Aminopyridine; p-Aminopyridine [PubChem Synonyms]
Exact Mass:
94.0531 (neutral)    Calculate m/z:
Formula:C5H6N2
InChIKey:NUKYPUAOHBNCPY-UHFFFAOYSA-N
ClassyFire superclass:Organoheterocyclic compounds [C0000002]
ClassyFire class:Pyridines and derivatives [C0000089]
ClassyFire subclass:Aminopyridines and derivatives [C0000283]
ClassyFire direct parent:Aminopyridines and derivatives [C0000283]
MoNA MS spectra:View MS spectra
SMILES:c1cnccc1N
Studies:Available studies (via RefMet name)

Select appropriate tab below to view additional details:

External database links:

PubChem CID:1727
CHEBI ID:34385
Plant Metabolite Hub(Pmhub):MS000023327

References

LIPID MAPS classification: "Update of the LIPID MAPS comprehensive classification system for lipids", Fahy E, Subramaniam S, Murphy RC, Nishijima M, Raetz CR, Shimizu T, Spener F, van Meer G, Wakelam MJ, and Dennis EA, J. Lipid Res. (2009) 50: S9-S14. DOI: 10.1194/jlr.R800095-JLR200
ClassyFire classification: "ClassyFire: automated chemical classification with a comprehensive, computable taxonomy", Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS, J. Cheminformatics (2016) 8:61. DOI: 10.1186/s13321-016-0174-y

  logo