CID 62148771

4-(pyrrolidine-1-sulfonyl)pyridin-2-amine

Structural Information

Molecular Formula
C9H13N3O2S
SMILES
C1CCN(C1)S(=O)(=O)C2=CC(=NC=C2)N
InChI
InChI=1S/C9H13N3O2S/c10-9-7-8(3-4-11-9)15(13,14)12-5-1-2-6-12/h3-4,7H,1-2,5-6H2,(H2,10,11)
InChIKey
LFBWBOXXVFBYQL-UHFFFAOYSA-N
Compound name
4-pyrrolidin-1-ylsulfonylpyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

227.07285 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.08013 148.6
[M+Na]+ 250.06207 156.6
[M-H]- 226.06557 152.5
[M+NH4]+ 245.10667 165.7
[M+K]+ 266.03601 153.3
[M+H-H2O]+ 210.07011 141.4
[M+HCOO]- 272.07105 164.6
[M+CH3COO]- 286.08670 185.0
[M+Na-2H]- 248.04752 151.2
[M]+ 227.07230 146.9
[M]- 227.07340 146.9
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.