CID 136532891

2-hydroxy-6-(2-methylpropyl)-n-{[6-(morpholin-4-yl)pyridin-2-yl]methyl}pyridine-4-carboxamide

Structural Information

Molecular Formula
C20H26N4O3
SMILES
CC(C)CC1=CC(=CC(=O)N1)C(=O)NCC2=NC(=CC=C2)N3CCOCC3
InChI
InChI=1S/C20H26N4O3/c1-14(2)10-17-11-15(12-19(25)23-17)20(26)21-13-16-4-3-5-18(22-16)24-6-8-27-9-7-24/h3-5,11-12,14H,6-10,13H2,1-2H3,(H,21,26)(H,23,25)
InChIKey
HYOVBZXSBRQSCL-UHFFFAOYSA-N
Compound name
2-(2-methylpropyl)-N-[(6-morpholin-4-yl-2-pyridinyl)methyl]-6-oxo-1H-pyridine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

370.2005 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 371.207776 191.7
[M+Na]+ 393.189718 195.1
[M-H]- 369.193224 195.6
[M+NH4]+ 388.234323 196.5
[M+K]+ 409.163658 190.8
[M+H-H2O]+ 353.197760 179.8
[M+HCOO]- 415.198701 204.4
[M+CH3COO]- 429.214351 217.4
[M+Na-2H]- 391.175166 192.3
[M]+ 370.19995142 188.1
[M]- 370.20104858 188.1
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.