CID 3072032

Oxazolo(4,5-b)pyridin-2(3h)-one, 3-(2-(1-piperidinyl)ethyl)-

Structural Information

Molecular Formula
C13H17N3O2
SMILES
C1CCN(CC1)CCN2C3=C(C=CC=N3)OC2=O
InChI
InChI=1S/C13H17N3O2/c17-13-16(10-9-15-7-2-1-3-8-15)12-11(18-13)5-4-6-14-12/h4-6H,1-3,7-10H2
InChIKey
BRJJFTOVFYBYMP-UHFFFAOYSA-N
Compound name
3-(2-piperidin-1-ylethyl)-[1,3]oxazolo[4,5-b]pyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

8
Patents

247.13208 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 248.139356 154.5
[M+Na]+ 270.121298 163.0
[M-H]- 246.124804 158.4
[M+NH4]+ 265.165903 169.0
[M+K]+ 286.095238 160.0
[M+H-H2O]+ 230.129340 145.0
[M+HCOO]- 292.130281 172.5
[M+CH3COO]- 306.145931 166.2
[M+Na-2H]- 268.106746 160.1
[M]+ 247.13153142 154.9
[M]- 247.13262858 154.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe