CID 493114

Chembl43053

Structural Information

Molecular Formula
C20H24FN3O2
SMILES
C1CN(C(=O)N1CCCCCCOC2=CC=C(C=C2)F)C3=CN=CC=C3
InChI
InChI=1S/C20H24FN3O2/c21-17-7-9-19(10-8-17)26-15-4-2-1-3-12-23-13-14-24(20(23)25)18-6-5-11-22-16-18/h5-11,16H,1-4,12-15H2
InChIKey
YWBCZHBECRUWIB-UHFFFAOYSA-N
Compound name
1-[6-(4-fluorophenoxy)hexyl]-3-pyridin-3-ylimidazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

357.18524 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 358.19252 186.1
[M+Na]+ 380.17446 192.0
[M-H]- 356.17796 189.6
[M+NH4]+ 375.21906 196.0
[M+K]+ 396.14840 186.0
[M+H-H2O]+ 340.18250 173.5
[M+HCOO]- 402.18344 203.1
[M+CH3COO]- 416.19909 213.6
[M+Na-2H]- 378.15991 185.6
[M]+ 357.18469 186.1
[M]- 357.18579 186.1
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.