CID 2813162

1-(3-cyanopyridin-2-yl)piperidine-4-carboxamide

Structural Information

Molecular Formula
C12H14N4O
SMILES
C1CN(CCC1C(=O)N)C2=C(C=CC=N2)C#N
InChI
InChI=1S/C12H14N4O/c13-8-10-2-1-5-15-12(10)16-6-3-9(4-7-16)11(14)17/h1-2,5,9H,3-4,6-7H2,(H2,14,17)
InChIKey
FWUQIBARTSKYEM-UHFFFAOYSA-N
Compound name
1-(3-cyanopyridin-2-yl)piperidine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

230.11676 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.12404 152.4
[M+Na]+ 253.10598 159.6
[M-H]- 229.10948 153.9
[M+NH4]+ 248.15058 164.8
[M+K]+ 269.07992 155.3
[M+H-H2O]+ 213.11402 136.9
[M+HCOO]- 275.11496 166.8
[M+CH3COO]- 289.13061 203.3
[M+Na-2H]- 251.09143 154.9
[M]+ 230.11621 141.7
[M]- 230.11731 141.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.