Structure

InChI Key JJMDCOVWQOJGCB-UHFFFAOYSA-N
Smiles NCCCCC(=O)O
InChI
InChI=1S/C5H11NO2/c6-4-2-1-3-5(7)8/h1-4,6H2,(H,7,8)

Physicochemical Descriptors

Property Name Value
Molecular Formula C5H11NO2
Molecular Weight 117.15
AlogP 0.2
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 4.0
Polar Surface Area 63.32
Molecular species ZWITTERION
Aromatic Rings 0.0
Heavy Atoms 8.0

Cross References

Resources Reference
ChEBI 356010
ChEMBL CHEMBL284116
FDA SRS BUW4BFJ6SC
Human Metabolome Database HMDB0003355
KEGG C00431
PDB KFB
SureChEMBL SCHEMBL190150
ZINC ZINC000001532654