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]+ 341.197176 183.7
[M+Na]+ 363.179118 187.4
[M-H]- 339.182624 189.9
[M+NH4]+ 358.223723 195.1
[M+K]+ 379.153058 184.7
[M+H-H2O]+ 323.187160 173.4
[M+HCOO]- 385.188101 207.4
[M+CH3COO]- 399.203751 223.3
[M+Na-2H]- 361.164566 186.0
[M]+ 340.18935142 184.9
[M]- 340.19044858 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.