CID 4961632

2-methyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine

Structural Information

Molecular Formula
C13H18N4
SMILES
CC1=C(N2C=CC=CC2=N1)CN3CCNCC3
InChI
InChI=1S/C13H18N4/c1-11-12(10-16-8-5-14-6-9-16)17-7-3-2-4-13(17)15-11/h2-4,7,14H,5-6,8-10H2,1H3
InChIKey
XNHBRUJFXUNHFT-UHFFFAOYSA-N
Compound name
2-methyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

230.15315 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.160426 154.4
[M+Na]+ 253.142368 162.3
[M-H]- 229.145874 154.9
[M+NH4]+ 248.186973 169.0
[M+K]+ 269.116308 156.7
[M+H-H2O]+ 213.150410 144.4
[M+HCOO]- 275.151351 169.9
[M+CH3COO]- 289.167001 164.7
[M+Na-2H]- 251.127816 158.9
[M]+ 230.15260142 150.8
[M]- 230.15369858 150.8
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.