CID 16228137

N-[2-(thiophen-2-yl)ethyl]piperidine-4-carboxamide hydrochloride

Structural Information

Molecular Formula
C12H18N2OS
SMILES
C1CNCCC1C(=O)NCCC2=CC=CS2
InChI
InChI=1S/C12H18N2OS/c15-12(10-3-6-13-7-4-10)14-8-5-11-2-1-9-16-11/h1-2,9-10,13H,3-8H2,(H,14,15)
InChIKey
VLTDHLUJIQCQPV-UHFFFAOYSA-N
Compound name
N-(2-thiophen-2-ylethyl)piperidine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

238.11398 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.121256 154.5
[M+Na]+ 261.103198 158.1
[M-H]- 237.106704 157.4
[M+NH4]+ 256.147803 171.6
[M+K]+ 277.077138 154.1
[M+H-H2O]+ 221.111240 147.2
[M+HCOO]- 283.112181 168.6
[M+CH3COO]- 297.127831 187.0
[M+Na-2H]- 259.088646 154.1
[M]+ 238.11343142 149.8
[M]- 238.11452858 149.8
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