CID 3049974

Nicotinamide, 2-(p-methoxyanilino)-n-methyl-

Structural Information

Molecular Formula
C14H15N3O2
SMILES
CNC(=O)C1=C(N=CC=C1)NC2=CC=C(C=C2)OC
InChI
InChI=1S/C14H15N3O2/c1-15-14(18)12-4-3-9-16-13(12)17-10-5-7-11(19-2)8-6-10/h3-9H,1-2H3,(H,15,18)(H,16,17)
InChIKey
YVKLLYDPDWCODC-UHFFFAOYSA-N
Compound name
2-(4-methoxyanilino)-N-methylpyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

257.11642 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.12370 157.7
[M+Na]+ 280.10564 164.4
[M-H]- 256.10914 163.4
[M+NH4]+ 275.15024 172.5
[M+K]+ 296.07958 161.2
[M+H-H2O]+ 240.11368 148.8
[M+HCOO]- 302.11462 182.5
[M+CH3COO]- 316.13027 200.4
[M+Na-2H]- 278.09109 164.1
[M]+ 257.11587 158.1
[M]- 257.11697 158.1
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.