CID 203435

O-anisamide, 4-amino-5-chloro-n-(2-piperidinoethyl)-

Structural Information

Molecular Formula
C15H22ClN3O2
SMILES
COC1=CC(=C(C=C1C(=O)NCCN2CCCCC2)Cl)N
InChI
InChI=1S/C15H22ClN3O2/c1-21-14-10-13(17)12(16)9-11(14)15(20)18-5-8-19-6-3-2-4-7-19/h9-10H,2-8,17H2,1H3,(H,18,20)
InChIKey
PSEIPXZUDCSBHO-UHFFFAOYSA-N
Compound name
4-amino-5-chloro-2-methoxy-N-(2-piperidin-1-ylethyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

311.14005 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 312.14733 172.2
[M+Na]+ 334.12927 182.7
[M+NH4]+ 329.17387 179.2
[M+K]+ 350.10321 176.2
[M-H]- 310.13277 175.8
[M+Na-2H]- 332.11472 177.4
[M]+ 311.13950 174.7
[M]- 311.14060 174.7
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

No patent data available for this compound.