CID 54592624

Dimethyl({[6-(piperazin-1-yl)pyridin-3-yl]methyl})amine

Structural Information

Molecular Formula
C12H20N4
SMILES
CN(C)CC1=CN=C(C=C1)N2CCNCC2
InChI
InChI=1S/C12H20N4/c1-15(2)10-11-3-4-12(14-9-11)16-7-5-13-6-8-16/h3-4,9,13H,5-8,10H2,1-2H3
InChIKey
ZDLPDXMAMPKGEG-UHFFFAOYSA-N
Compound name
N,N-dimethyl-1-(6-piperazin-1-ylpyridin-3-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

220.1688 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.17608 153.3
[M+Na]+ 243.15802 157.5
[M-H]- 219.16152 154.7
[M+NH4]+ 238.20262 166.7
[M+K]+ 259.13196 154.5
[M+H-H2O]+ 203.16606 143.3
[M+HCOO]- 265.16700 170.0
[M+CH3COO]- 279.18265 192.0
[M+Na-2H]- 241.14347 158.0
[M]+ 220.16825 147.9
[M]- 220.16935 147.9
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.