CID 11675969

1-[2-(imidazo(4,5-b)pyridin-2-yl]ethoxy]-2,6-diphenyl)piperidin-4-one

Structural Information

Molecular Formula
C25H24N4O2
SMILES
C1C(N(C(CC1=O)C2=CC=CC=C2)OCCC3=NC4=C(N3)C=CC=N4)C5=CC=CC=C5
InChI
InChI=1S/C25H24N4O2/c30-20-16-22(18-8-3-1-4-9-18)29(23(17-20)19-10-5-2-6-11-19)31-15-13-24-27-21-12-7-14-26-25(21)28-24/h1-12,14,22-23H,13,15-17H2,(H,26,27,28)
InChIKey
ZSMUCKVQRZTUBS-UHFFFAOYSA-N
Compound name
1-[2-(1H-imidazo[4,5-b]pyridin-2-yl)ethoxy]-2,6-diphenylpiperidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

412.1899 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 413.19718 200.8
[M+Na]+ 435.17912 207.1
[M-H]- 411.18262 207.2
[M+NH4]+ 430.22372 206.5
[M+K]+ 451.15306 198.2
[M+H-H2O]+ 395.18716 187.0
[M+HCOO]- 457.18810 214.7
[M+CH3COO]- 471.20375 207.7
[M+Na-2H]- 433.16457 201.9
[M]+ 412.18935 198.2
[M]- 412.19045 198.2
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.