CID 215940

3-pyridinecarboxamide, 6-(2-(diethylamino)ethoxy)-n-(2,6-dimethylphenyl)-

Structural Information

Molecular Formula
C20H27N3O2
SMILES
CCN(CC)CCOC1=NC=C(C=C1)C(=O)NC2=C(C=CC=C2C)C
InChI
InChI=1S/C20H27N3O2/c1-5-23(6-2)12-13-25-18-11-10-17(14-21-18)20(24)22-19-15(3)8-7-9-16(19)4/h7-11,14H,5-6,12-13H2,1-4H3,(H,22,24)
InChIKey
GVVZQMYYQUDNMD-UHFFFAOYSA-N
Compound name
6-[2-(diethylamino)ethoxy]-N-(2,6-dimethylphenyl)pyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

341.21033 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.21761 185.5
[M+Na]+ 364.19955 190.5
[M-H]- 340.20305 191.8
[M+NH4]+ 359.24415 197.7
[M+K]+ 380.17349 187.5
[M+H-H2O]+ 324.20759 175.4
[M+HCOO]- 386.20853 208.6
[M+CH3COO]- 400.22418 222.8
[M+Na-2H]- 362.18500 187.1
[M]+ 341.20978 189.6
[M]- 341.21088 189.6
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.