CID 5481691

Chembl2263583

Structural Information

Molecular Formula
C16H20N4O3
SMILES
C1COCCN1C2=CC(=NC3=C2C=CC(=O)N3)N4CCOCC4
InChI
InChI=1S/C16H20N4O3/c21-15-2-1-12-13(19-3-7-22-8-4-19)11-14(17-16(12)18-15)20-5-9-23-10-6-20/h1-2,11H,3-10H2,(H,17,18,21)
InChIKey
SONQXUBFESJTBT-UHFFFAOYSA-N
Compound name
5,7-dimorpholin-4-yl-1H-1,8-naphthyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

316.15353 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 317.16081 176.7
[M+Na]+ 339.14275 181.6
[M-H]- 315.14625 180.2
[M+NH4]+ 334.18735 182.0
[M+K]+ 355.11669 178.1
[M+H-H2O]+ 299.15079 164.0
[M+HCOO]- 361.15173 184.4
[M+CH3COO]- 375.16738 184.0
[M+Na-2H]- 337.12820 180.6
[M]+ 316.15298 169.9
[M]- 316.15408 169.9
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

No patent data available for this compound.