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]+ 256.14444 159.7
[M+Na]+ 278.12638 167.0
[M-H]- 254.12988 165.5
[M+NH4]+ 273.17098 175.0
[M+K]+ 294.10032 163.0
[M+H-H2O]+ 238.13442 151.1
[M+HCOO]- 300.13536 183.9
[M+CH3COO]- 314.15101 202.4
[M+Na-2H]- 276.11183 164.7
[M]+ 255.13661 159.4
[M]- 255.13771 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.