CID 2773944

N-cyclopropyl-n-piperidin-4-yl-3-(trifluoromethyl)benzenesulfonamide

Structural Information

Molecular Formula
C15H19F3N2O2S
SMILES
C1CC1N(C2CCNCC2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F
InChI
InChI=1S/C15H19F3N2O2S/c16-15(17,18)11-2-1-3-14(10-11)23(21,22)20(12-4-5-12)13-6-8-19-9-7-13/h1-3,10,12-13,19H,4-9H2
InChIKey
NQBHDSLGAKITFX-UHFFFAOYSA-N
Compound name
N-cyclopropyl-N-piperidin-4-yl-3-(trifluoromethyl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

348.11194 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 349.11922 166.4
[M+Na]+ 371.10116 172.1
[M-H]- 347.10466 170.1
[M+NH4]+ 366.14576 173.1
[M+K]+ 387.07510 167.0
[M+H-H2O]+ 331.10920 156.0
[M+HCOO]- 393.11014 175.5
[M+CH3COO]- 407.12579 210.7
[M+Na-2H]- 369.08661 168.4
[M]+ 348.11139 161.9
[M]- 348.11249 161.9
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