CID 3061038

N,6-dimethyl-2-(p-toluidino)nicotinamide

Structural Information

Molecular Formula
C15H17N3O
SMILES
CC1=CC=C(C=C1)NC2=C(C=CC(=N2)C)C(=O)NC
InChI
InChI=1S/C15H17N3O/c1-10-4-7-12(8-5-10)18-14-13(15(19)16-3)9-6-11(2)17-14/h4-9H,1-3H3,(H,16,19)(H,17,18)
InChIKey
REXNCPCFYOEOTM-UHFFFAOYSA-N
Compound name
N,6-dimethyl-2-(4-methylanilino)pyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

255.13716 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.144436 159.7
[M+Na]+ 278.126378 167.0
[M-H]- 254.129884 165.5
[M+NH4]+ 273.170983 175.0
[M+K]+ 294.100318 163.0
[M+H-H2O]+ 238.134420 151.1
[M+HCOO]- 300.135361 183.9
[M+CH3COO]- 314.151011 202.4
[M+Na-2H]- 276.111826 164.7
[M]+ 255.13661142 159.4
[M]- 255.13770858 159.4
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.