CID 137700069

2-methyl-n-(1-phenethylpiperidin-4-yl)-n-phenylbutanamide

Structural Information

Molecular Formula
C24H32N2O
SMILES
CCC(C)C(=O)N(C1CCN(CC1)CCC2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C24H32N2O/c1-3-20(2)24(27)26(22-12-8-5-9-13-22)23-15-18-25(19-16-23)17-14-21-10-6-4-7-11-21/h4-13,20,23H,3,14-19H2,1-2H3
InChIKey
DRAWSQJHCQAWNN-UHFFFAOYSA-N
Compound name
2-methyl-N-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]butanamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

364.25146 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 365.25874 192.9
[M+Na]+ 387.24068 193.0
[M-H]- 363.24418 200.0
[M+NH4]+ 382.28528 202.8
[M+K]+ 403.21462 188.8
[M+H-H2O]+ 347.24872 181.5
[M+HCOO]- 409.24966 209.3
[M+CH3COO]- 423.26531 223.0
[M+Na-2H]- 385.22613 191.7
[M]+ 364.25091 189.1
[M]- 364.25201 189.1
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.