CID 209286

N-(8-butoxy-5-quinolyl)-1-piperidineacetamide dihydrochloride

Structural Information

Molecular Formula
C20H27N3O2
SMILES
CCCCOC1=C2C(=C(C=C1)NC(=O)CN3CCCCC3)C=CC=N2
InChI
InChI=1S/C20H27N3O2/c1-2-3-14-25-18-10-9-17(16-8-7-11-21-20(16)18)22-19(24)15-23-12-5-4-6-13-23/h7-11H,2-6,12-15H2,1H3,(H,22,24)
InChIKey
BPWVZCGHAURXML-UHFFFAOYSA-N
Compound name
N-(8-butoxyquinolin-5-yl)-2-piperidin-1-ylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

341.21033 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.21761 183.6
[M+Na]+ 364.19955 186.5
[M-H]- 340.20305 186.5
[M+NH4]+ 359.24415 194.2
[M+K]+ 380.17349 181.7
[M+H-H2O]+ 324.20759 172.6
[M+HCOO]- 386.20853 199.2
[M+CH3COO]- 400.22418 214.7
[M+Na-2H]- 362.18500 186.6
[M]+ 341.20978 181.5
[M]- 341.21088 181.5
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

No patent data available for this compound.