CID 37980

N-(morpholinomethyl)isonicotinamide

Structural Information

Molecular Formula
C11H15N3O2
SMILES
C1COCCN1CNC(=O)C2=CC=NC=C2
InChI
InChI=1S/C11H15N3O2/c15-11(10-1-3-12-4-2-10)13-9-14-5-7-16-8-6-14/h1-4H,5-9H2,(H,13,15)
InChIKey
IKYSADCBVOJABA-UHFFFAOYSA-N
Compound name
N-(morpholin-4-ylmethyl)pyridine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

221.11642 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.12370 149.6
[M+Na]+ 244.10564 153.6
[M-H]- 220.10914 153.0
[M+NH4]+ 239.15024 162.6
[M+K]+ 260.07958 152.5
[M+H-H2O]+ 204.11368 140.1
[M+HCOO]- 266.11462 167.7
[M+CH3COO]- 280.13027 187.8
[M+Na-2H]- 242.09109 156.3
[M]+ 221.11587 145.6
[M]- 221.11697 145.6
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.