CID 16787711

1-(2-aminobenzoyl)piperidine-4-carboxamide

Structural Information

Molecular Formula
C13H17N3O2
SMILES
C1CN(CCC1C(=O)N)C(=O)C2=CC=CC=C2N
InChI
InChI=1S/C13H17N3O2/c14-11-4-2-1-3-10(11)13(18)16-7-5-9(6-8-16)12(15)17/h1-4,9H,5-8,14H2,(H2,15,17)
InChIKey
ZGYGMDQRBJQHDA-UHFFFAOYSA-N
Compound name
1-(2-aminobenzoyl)piperidine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

247.13208 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 248.139356 157.2
[M+Na]+ 270.121298 161.3
[M-H]- 246.124804 160.9
[M+NH4]+ 265.165903 171.5
[M+K]+ 286.095238 158.3
[M+H-H2O]+ 230.129340 148.9
[M+HCOO]- 292.130281 175.9
[M+CH3COO]- 306.145931 197.5
[M+Na-2H]- 268.106746 157.8
[M]+ 247.13153142 149.7
[M]- 247.13262858 149.7
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.