CID 217026

38029-92-4

Structural Information

Molecular Formula
C12H20N4O2S
SMILES
CN1CCN(CC1)C2=NC=C(C=C2)S(=O)(=O)N(C)C
InChI
InChI=1S/C12H20N4O2S/c1-14(2)19(17,18)11-4-5-12(13-10-11)16-8-6-15(3)7-9-16/h4-5,10H,6-9H2,1-3H3
InChIKey
AHUUBRNXCPBSRD-UHFFFAOYSA-N
Compound name
N,N-dimethyl-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

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.137976 164.6
[M+Na]+ 307.119918 171.2
[M-H]- 283.123424 168.3
[M+NH4]+ 302.164523 177.1
[M+K]+ 323.093858 168.4
[M+H-H2O]+ 267.127960 155.6
[M+HCOO]- 329.128901 177.0
[M+CH3COO]- 343.144551 202.5
[M+Na-2H]- 305.105366 167.2
[M]+ 284.13015142 164.7
[M]- 284.13124858 164.7
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.