CID 4461797

5-(morpholine-4-sulfonyl)-2-(piperidin-1-yl)aniline

Structural Information

Molecular Formula
C15H23N3O3S
SMILES
C1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N
InChI
InChI=1S/C15H23N3O3S/c16-14-12-13(22(19,20)18-8-10-21-11-9-18)4-5-15(14)17-6-2-1-3-7-17/h4-5,12H,1-3,6-11,16H2
InChIKey
HLHUIDAFOLDZDE-UHFFFAOYSA-N
Compound name
5-morpholin-4-ylsulfonyl-2-piperidin-1-ylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

325.14603 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.15331 174.4
[M+Na]+ 348.13525 177.8
[M-H]- 324.13875 179.9
[M+NH4]+ 343.17985 183.5
[M+K]+ 364.10919 174.5
[M+H-H2O]+ 308.14329 165.0
[M+HCOO]- 370.14423 182.7
[M+CH3COO]- 384.15988 204.4
[M+Na-2H]- 346.12070 175.8
[M]+ 325.14548 168.0
[M]- 325.14658 168.0
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.