CID 769352

N-(1-benzyl-4-piperidinyl)-n'-cyclohexylurea

Structural Information

Molecular Formula
C19H29N3O
SMILES
C1CCC(CC1)NC(=O)NC2CCN(CC2)CC3=CC=CC=C3
InChI
InChI=1S/C19H29N3O/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/h1,3-4,7-8,17-18H,2,5-6,9-15H2,(H2,20,21,23)
InChIKey
NYVAUBXJQMOULV-UHFFFAOYSA-N
Compound name
1-(1-benzylpiperidin-4-yl)-3-cyclohexylurea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

315.23105 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 316.23833 180.4
[M+Na]+ 338.22027 189.5
[M+NH4]+ 333.26487 188.2
[M+K]+ 354.19421 181.8
[M-H]- 314.22377 186.7
[M+Na-2H]- 336.20572 187.3
[M]+ 315.23050 183.1
[M]- 315.23160 183.1
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.