CID 54594816

5-(piperidin-4-yl)-1,2,4-oxadiazole-3-carboxamide

Structural Information

Molecular Formula
C8H12N4O2
SMILES
C1CNCCC1C2=NC(=NO2)C(=O)N
InChI
InChI=1S/C8H12N4O2/c9-6(13)7-11-8(14-12-7)5-1-3-10-4-2-5/h5,10H,1-4H2,(H2,9,13)
InChIKey
NCUCFYOWXBVYPY-UHFFFAOYSA-N
Compound name
5-piperidin-4-yl-1,2,4-oxadiazole-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

196.09602 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.10330 142.6
[M+Na]+ 219.08524 148.2
[M-H]- 195.08874 143.7
[M+NH4]+ 214.12984 156.5
[M+K]+ 235.05918 146.7
[M+H-H2O]+ 179.09328 133.8
[M+HCOO]- 241.09422 159.0
[M+CH3COO]- 255.10987 180.3
[M+Na-2H]- 217.07069 145.8
[M]+ 196.09547 136.6
[M]- 196.09657 136.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.