CID 3061039

2-(p-anisidino)-n,6-dimethylnicotinamide

Structural Information

Molecular Formula
C15H17N3O2
SMILES
CC1=NC(=C(C=C1)C(=O)NC)NC2=CC=C(C=C2)OC
InChI
InChI=1S/C15H17N3O2/c1-10-4-9-13(15(19)16-2)14(17-10)18-11-5-7-12(20-3)8-6-11/h4-9H,1-3H3,(H,16,19)(H,17,18)
InChIKey
KNPXXFHXSZCXSC-UHFFFAOYSA-N
Compound name
2-(4-methoxyanilino)-N,6-dimethylpyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

271.13208 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.13936 162.7
[M+Na]+ 294.12130 169.8
[M-H]- 270.12480 168.5
[M+NH4]+ 289.16590 177.2
[M+K]+ 310.09524 166.5
[M+H-H2O]+ 254.12934 153.8
[M+HCOO]- 316.13028 187.1
[M+CH3COO]- 330.14593 204.6
[M+Na-2H]- 292.10675 167.7
[M]+ 271.13153 163.8
[M]- 271.13263 163.8
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.