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]+ 342.217606 185.5
[M+Na]+ 364.199548 190.5
[M-H]- 340.203054 191.8
[M+NH4]+ 359.244153 197.7
[M+K]+ 380.173488 187.5
[M+H-H2O]+ 324.207590 175.4
[M+HCOO]- 386.208531 208.6
[M+CH3COO]- 400.224181 222.8
[M+Na-2H]- 362.184996 187.1
[M]+ 341.20978142 189.6
[M]- 341.21087858 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.