CID 16227493

1-(5-carbamoylpyridin-2-yl)piperidine-4-carboxylic acid

Structural Information

Molecular Formula
C12H15N3O3
SMILES
C1CN(CCC1C(=O)O)C2=NC=C(C=C2)C(=O)N
InChI
InChI=1S/C12H15N3O3/c13-11(16)9-1-2-10(14-7-9)15-5-3-8(4-6-15)12(17)18/h1-2,7-8H,3-6H2,(H2,13,16)(H,17,18)
InChIKey
WGGYGZHZMWRLOV-UHFFFAOYSA-N
Compound name
1-(5-carbamoylpyridin-2-yl)piperidine-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

249.11134 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.11862 155.9
[M+Na]+ 272.10056 165.5
[M+NH4]+ 267.14516 161.4
[M+K]+ 288.07450 161.9
[M-H]- 248.10406 157.0
[M+Na-2H]- 270.08601 160.4
[M]+ 249.11079 157.1
[M]- 249.11189 157.1
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

patents stripe