CID 3029545

3-pyridinecarboxamide, n-ethyl-2-((4-methoxyphenyl)amino)-6-methyl-

Structural Information

Molecular Formula
C16H19N3O2
SMILES
CCNC(=O)C1=C(N=C(C=C1)C)NC2=CC=C(C=C2)OC
InChI
InChI=1S/C16H19N3O2/c1-4-17-16(20)14-10-5-11(2)18-15(14)19-12-6-8-13(21-3)9-7-12/h5-10H,4H2,1-3H3,(H,17,20)(H,18,19)
InChIKey
YKQKOCLTWGUVCX-UHFFFAOYSA-N
Compound name
N-ethyl-2-(4-methoxyanilino)-6-methylpyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

285.14774 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.15502 167.2
[M+Na]+ 308.13696 173.9
[M-H]- 284.14046 172.8
[M+NH4]+ 303.18156 181.1
[M+K]+ 324.11090 170.4
[M+H-H2O]+ 268.14500 158.1
[M+HCOO]- 330.14594 191.2
[M+CH3COO]- 344.16159 207.6
[M+Na-2H]- 306.12241 171.7
[M]+ 285.14719 168.7
[M]- 285.14829 168.7
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.