CID 135491419

Chembl3091643

Structural Information

Molecular Formula
C19H24N4O2
SMILES
CCN(CC)CC1=C(C(=CC=C1)/C(=N/NC(=O)C2=CC=NC=C2)/C)O
InChI
InChI=1S/C19H24N4O2/c1-4-23(5-2)13-16-7-6-8-17(18(16)24)14(3)21-22-19(25)15-9-11-20-12-10-15/h6-12,24H,4-5,13H2,1-3H3,(H,22,25)/b21-14+
InChIKey
HAJACCHAKAUFJM-KGENOOAVSA-N
Compound name
N-[(E)-1-[3-(diethylaminomethyl)-2-hydroxyphenyl]ethylideneamino]pyridine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

340.1899 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 341.19718 183.7
[M+Na]+ 363.17912 187.4
[M-H]- 339.18262 189.9
[M+NH4]+ 358.22372 195.1
[M+K]+ 379.15306 184.7
[M+H-H2O]+ 323.18716 173.4
[M+HCOO]- 385.18810 207.4
[M+CH3COO]- 399.20375 223.3
[M+Na-2H]- 361.16457 186.0
[M]+ 340.18935 184.9
[M]- 340.19045 184.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.