CID 485732

Acetamide, n-[[(5s)-3-[3-fluoro-4-[[1-(2-pyridinyl)-4-piperidinyl]oxy]phenyl]-2-oxo-5-oxazolidinyl]methyl]-

Structural Information

Molecular Formula
C22H25FN4O4
SMILES
CC(=O)NC[C@H]1CN(C(=O)O1)C2=CC(=C(C=C2)OC3CCN(CC3)C4=CC=CC=N4)F
InChI
InChI=1S/C22H25FN4O4/c1-15(28)25-13-18-14-27(22(29)31-18)16-5-6-20(19(23)12-16)30-17-7-10-26(11-8-17)21-4-2-3-9-24-21/h2-6,9,12,17-18H,7-8,10-11,13-14H2,1H3,(H,25,28)/t18-/m0/s1
InChIKey
IXAHLUHTUIAOSP-SFHVURJKSA-N
Compound name
N-[[(5S)-3-[3-fluoro-4-(1-pyridin-2-ylpiperidin-4-yl)oxyphenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

428.18597 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 429.19325 202.5
[M+Na]+ 451.17519 206.4
[M-H]- 427.17869 209.8
[M+NH4]+ 446.21979 207.1
[M+K]+ 467.14913 202.3
[M+H-H2O]+ 411.18323 189.3
[M+HCOO]- 473.18417 215.2
[M+CH3COO]- 487.19982 228.6
[M+Na-2H]- 449.16064 199.1
[M]+ 428.18542 198.6
[M]- 428.18652 198.6
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.