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]+ 248.13936 157.2
[M+Na]+ 270.12130 161.3
[M-H]- 246.12480 160.9
[M+NH4]+ 265.16590 171.5
[M+K]+ 286.09524 158.3
[M+H-H2O]+ 230.12934 148.9
[M+HCOO]- 292.13028 175.9
[M+CH3COO]- 306.14593 197.5
[M+Na-2H]- 268.10675 157.8
[M]+ 247.13153 149.7
[M]- 247.13263 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.