CID 217027

3-pyridinesulfonamide, n-ethyl-6-(4-methyl-1-piperazinyl)-

Structural Information

Molecular Formula
C12H20N4O2S
SMILES
CCNS(=O)(=O)C1=CN=C(C=C1)N2CCN(CC2)C
InChI
InChI=1S/C12H20N4O2S/c1-3-14-19(17,18)11-4-5-12(13-10-11)16-8-6-15(2)7-9-16/h4-5,10,14H,3,6-9H2,1-2H3
InChIKey
VKSFPOXEASNWNQ-UHFFFAOYSA-N
Compound name
N-ethyl-6-(4-methylpiperazin-1-yl)pyridine-3-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

284.1307 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.137976 165.3
[M+Na]+ 307.119918 171.8
[M-H]- 283.123424 167.5
[M+NH4]+ 302.164523 177.1
[M+K]+ 323.093858 167.5
[M+H-H2O]+ 267.127960 156.4
[M+HCOO]- 329.128901 177.2
[M+CH3COO]- 343.144551 199.1
[M+Na-2H]- 305.105366 168.5
[M]+ 284.13015142 164.1
[M]- 284.13124858 164.1
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.