CID 4064342

3-(1-benzylpiperidin-4-yl)-1-phenylurea

Structural Information

Molecular Formula
C19H23N3O
SMILES
C1CN(CCC1NC(=O)NC2=CC=CC=C2)CC3=CC=CC=C3
InChI
InChI=1S/C19H23N3O/c23-19(20-17-9-5-2-6-10-17)21-18-11-13-22(14-12-18)15-16-7-3-1-4-8-16/h1-10,18H,11-15H2,(H2,20,21,23)
InChIKey
FBRUCPZAISLOOV-UHFFFAOYSA-N
Compound name
1-(1-benzylpiperidin-4-yl)-3-phenylurea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

17
Patents

309.1841 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 310.19138 176.7
[M+Na]+ 332.17332 188.7
[M+NH4]+ 327.21792 184.7
[M+K]+ 348.14726 180.3
[M-H]- 308.17682 183.6
[M+Na-2H]- 330.15877 186.3
[M]+ 309.18355 180.2
[M]- 309.18465 180.2
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

patents stripe