CID 2060063

3-amino-4-(piperidin-1-yl)benzamide

Structural Information

Molecular Formula
C12H17N3O
SMILES
C1CCN(CC1)C2=C(C=C(C=C2)C(=O)N)N
InChI
InChI=1S/C12H17N3O/c13-10-8-9(12(14)16)4-5-11(10)15-6-2-1-3-7-15/h4-5,8H,1-3,6-7,13H2,(H2,14,16)
InChIKey
PMPIUPQQXZIRFH-UHFFFAOYSA-N
Compound name
3-amino-4-piperidin-1-ylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

12
Patents

219.13716 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.14444 150.5
[M+Na]+ 242.12638 160.7
[M+NH4]+ 237.17098 158.2
[M+K]+ 258.10032 155.2
[M-H]- 218.12988 154.5
[M+Na-2H]- 240.11183 156.6
[M]+ 219.13661 152.7
[M]- 219.13771 152.7
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

patents stripe