CID 3042938

Lt 174

Structural Information

Molecular Formula
C13H20N4O
SMILES
CN1CCN(CC1)C2=NC=C(C=C2)C(=O)N(C)C
InChI
InChI=1S/C13H20N4O/c1-15(2)13(18)11-4-5-12(14-10-11)17-8-6-16(3)7-9-17/h4-5,10H,6-9H2,1-3H3
InChIKey
PYZQIXNHIIKFNQ-UHFFFAOYSA-N
Compound name
N,N-dimethyl-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

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.17099 159.7
[M+Na]+ 271.15293 164.9
[M-H]- 247.15643 162.9
[M+NH4]+ 266.19753 172.9
[M+K]+ 287.12687 162.9
[M+H-H2O]+ 231.16097 149.5
[M+HCOO]- 293.16191 177.0
[M+CH3COO]- 307.17756 200.2
[M+Na-2H]- 269.13838 162.5
[M]+ 248.16316 157.0
[M]- 248.16426 157.0
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.