CID 819331

Lt 151

Structural Information

Molecular Formula
C13H20N4O
SMILES
CCNC(=O)C1=CN=C(C=C1)N2CCN(CC2)C
InChI
InChI=1S/C13H20N4O/c1-3-14-13(18)11-4-5-12(15-10-11)17-8-6-16(2)7-9-17/h4-5,10H,3,6-9H2,1-2H3,(H,14,18)
InChIKey
LZQJFOLTKREEEO-UHFFFAOYSA-N
Compound name
N-ethyl-6-(4-methylpiperazin-1-yl)pyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

248.16371 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.17099 160.4
[M+Na]+ 271.15293 165.4
[M-H]- 247.15643 162.1
[M+NH4]+ 266.19753 173.0
[M+K]+ 287.12687 162.1
[M+H-H2O]+ 231.16097 150.4
[M+HCOO]- 293.16191 177.2
[M+CH3COO]- 307.17756 196.8
[M+Na-2H]- 269.13838 163.8
[M]+ 248.16316 156.4
[M]- 248.16426 156.4
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.