CID 985721

N-(4-cyclohexylphenyl)-2-(4-phenylpiperazin-1-yl)acetamide

Structural Information

Molecular Formula
C24H31N3O
SMILES
C1CCC(CC1)C2=CC=C(C=C2)NC(=O)CN3CCN(CC3)C4=CC=CC=C4
InChI
InChI=1S/C24H31N3O/c28-24(19-26-15-17-27(18-16-26)23-9-5-2-6-10-23)25-22-13-11-21(12-14-22)20-7-3-1-4-8-20/h2,5-6,9-14,20H,1,3-4,7-8,15-19H2,(H,25,28)
InChIKey
ZBLBVESPANLDBZ-UHFFFAOYSA-N
Compound name
N-(4-cyclohexylphenyl)-2-(4-phenylpiperazin-1-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

377.2467 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 378.25398 193.9
[M+Na]+ 400.23592 193.2
[M-H]- 376.23942 200.6
[M+NH4]+ 395.28052 200.6
[M+K]+ 416.20986 186.8
[M+H-H2O]+ 360.24396 180.6
[M+HCOO]- 422.24490 206.2
[M+CH3COO]- 436.26055 199.4
[M+Na-2H]- 398.22137 193.3
[M]+ 377.24615 183.2
[M]- 377.24725 183.2
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

patents stripe