CID 16785528

1-[3-(aminomethyl)pyridin-2-yl]piperidine-4-carboxamide

Structural Information

Molecular Formula
C12H18N4O
SMILES
C1CN(CCC1C(=O)N)C2=C(C=CC=N2)CN
InChI
InChI=1S/C12H18N4O/c13-8-10-2-1-5-15-12(10)16-6-3-9(4-7-16)11(14)17/h1-2,5,9H,3-4,6-8,13H2,(H2,14,17)
InChIKey
FLLKLLDZTJMJPX-UHFFFAOYSA-N
Compound name
1-[3-(aminomethyl)-2-pyridinyl]piperidine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

234.14806 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.155336 154.9
[M+Na]+ 257.137278 159.5
[M-H]- 233.140784 157.3
[M+NH4]+ 252.181883 168.5
[M+K]+ 273.111218 156.0
[M+H-H2O]+ 217.145320 145.8
[M+HCOO]- 279.146261 173.2
[M+CH3COO]- 293.161911 195.6
[M+Na-2H]- 255.122726 157.4
[M]+ 234.14751142 147.6
[M]- 234.14860858 147.6
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.