CID 3070293

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

Structural Information

Molecular Formula
C17H25N3O3
SMILES
CC1(C(=O)N(C2=C(O1)C=CC=N2)CC(CN3CCCCC3)O)C
InChI
InChI=1S/C17H25N3O3/c1-17(2)16(22)20(15-14(23-17)7-6-8-18-15)12-13(21)11-19-9-4-3-5-10-19/h6-8,13,21H,3-5,9-12H2,1-2H3
InChIKey
NUAFZVXHHKQTAV-UHFFFAOYSA-N
Compound name
4-(2-hydroxy-3-piperidin-1-ylpropyl)-2,2-dimethylpyrido[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

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 320.19688 178.7
[M+Na]+ 342.17882 190.0
[M+NH4]+ 337.22342 186.1
[M+K]+ 358.15276 182.5
[M-H]- 318.18232 181.3
[M+Na-2H]- 340.16427 182.9
[M]+ 319.18905 181.0
[M]- 319.19015 181.0
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.