CID 2741378

Oprea1_090564

Structural Information

Molecular Formula
C19H25N5O4
SMILES
CC1=C(C(=NO1)C)C(=O)NC2=C(N=C(C=C2)N3CCOCC3)N4CCOCC4
InChI
InChI=1S/C19H25N5O4/c1-13-17(14(2)28-22-13)19(25)20-15-3-4-16(23-5-9-26-10-6-23)21-18(15)24-7-11-27-12-8-24/h3-4H,5-12H2,1-2H3,(H,20,25)
InChIKey
NRIFRNPJUJDTRK-UHFFFAOYSA-N
Compound name
N-(2,6-dimorpholin-4-yl-3-pyridinyl)-3,5-dimethyl-1,2-oxazole-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

387.19064 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 388.197916 196.3
[M+Na]+ 410.179858 199.9
[M-H]- 386.183364 204.5
[M+NH4]+ 405.224463 198.5
[M+K]+ 426.153798 198.8
[M+H-H2O]+ 370.187900 183.9
[M+HCOO]- 432.188841 206.2
[M+CH3COO]- 446.204491 203.2
[M+Na-2H]- 408.165306 194.6
[M]+ 387.19009142 193.0
[M]- 387.19118858 193.0
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

No patent data available for this compound.