CID 16790884

1-(4-aminophenyl)piperidine-4-carboxamide

Structural Information

Molecular Formula
C12H17N3O
SMILES
C1CN(CCC1C(=O)N)C2=CC=C(C=C2)N
InChI
InChI=1S/C12H17N3O/c13-10-1-3-11(4-2-10)15-7-5-9(6-8-15)12(14)16/h1-4,9H,5-8,13H2,(H2,14,16)
InChIKey
SXFSOZCNRLOVFG-UHFFFAOYSA-N
Compound name
1-(4-aminophenyl)piperidine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

111
Patents

219.13716 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.14444 150.4
[M+Na]+ 242.12638 155.0
[M-H]- 218.12988 154.2
[M+NH4]+ 237.17098 166.0
[M+K]+ 258.10032 151.6
[M+H-H2O]+ 202.13442 142.2
[M+HCOO]- 264.13536 170.0
[M+CH3COO]- 278.15101 192.8
[M+Na-2H]- 240.11183 152.7
[M]+ 219.13661 142.5
[M]- 219.13771 142.5
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