CID 60806420

N-(piperidin-4-yl)-n-propylthiophene-2-carboxamide hydrochloride

Structural Information

Molecular Formula
C13H20N2OS
SMILES
CCCN(C1CCNCC1)C(=O)C2=CC=CS2
InChI
InChI=1S/C13H20N2OS/c1-2-9-15(11-5-7-14-8-6-11)13(16)12-4-3-10-17-12/h3-4,10-11,14H,2,5-9H2,1H3
InChIKey
HWIFMYOETBHSMP-UHFFFAOYSA-N
Compound name
N-piperidin-4-yl-N-propylthiophene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

252.12964 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.13692 159.6
[M+Na]+ 275.11886 162.9
[M-H]- 251.12236 163.9
[M+NH4]+ 270.16346 176.8
[M+K]+ 291.09280 160.1
[M+H-H2O]+ 235.12690 152.0
[M+HCOO]- 297.12784 173.9
[M+CH3COO]- 311.14349 193.4
[M+Na-2H]- 273.10431 158.0
[M]+ 252.12909 156.6
[M]- 252.13019 156.6
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.