CID 3070294

2-ethyl-4-(2-hydroxy-3-(1-piperidinyl)propyl)-2h-pyrido(3,2-b)-1,4-oxazin-3(4h)-one

Structural Information

Molecular Formula
C17H25N3O3
SMILES
CCC1C(=O)N(C2=C(O1)C=CC=N2)CC(CN3CCCCC3)O
InChI
InChI=1S/C17H25N3O3/c1-2-14-17(22)20(16-15(23-14)7-6-8-18-16)12-13(21)11-19-9-4-3-5-10-19/h6-8,13-14,21H,2-5,9-12H2,1H3
InChIKey
FYBRVALMWWUWQG-UHFFFAOYSA-N
Compound name
2-ethyl-4-(2-hydroxy-3-piperidin-1-ylpropyl)pyrido[3,2-b][1,4]oxazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

319.1896 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 320.196876 179.2
[M+Na]+ 342.178818 182.9
[M-H]- 318.182324 180.2
[M+NH4]+ 337.223423 187.7
[M+K]+ 358.152758 179.6
[M+H-H2O]+ 302.186860 168.5
[M+HCOO]- 364.187801 188.2
[M+CH3COO]- 378.203451 206.1
[M+Na-2H]- 340.164266 180.4
[M]+ 319.18905142 175.1
[M]- 319.19014858 175.1
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.