CID 2761145

2-(5-piperidin-4-yl-1,2,4-oxadiazol-3-yl)pyrazine

Structural Information

Molecular Formula
C11H13N5O
SMILES
C1CNCCC1C2=NC(=NO2)C3=NC=CN=C3
InChI
InChI=1S/C11H13N5O/c1-3-12-4-2-8(1)11-15-10(16-17-11)9-7-13-5-6-14-9/h5-8,12H,1-4H2
InChIKey
KYFNBVXPLAKRKM-UHFFFAOYSA-N
Compound name
5-piperidin-4-yl-3-pyrazin-2-yl-1,2,4-oxadiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

231.11201 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.119286 152.0
[M+Na]+ 254.101228 158.7
[M-H]- 230.104734 153.7
[M+NH4]+ 249.145833 161.8
[M+K]+ 270.075168 155.0
[M+H-H2O]+ 214.109270 140.5
[M+HCOO]- 276.110211 166.0
[M+CH3COO]- 290.125861 161.7
[M+Na-2H]- 252.086676 156.8
[M]+ 231.11146142 146.9
[M]- 231.11255858 146.9
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

patents stripe