CID 3074080

155125-84-1

Structural Information

Molecular Formula
C24H33N3O
SMILES
CCC(=O)N(C1CCN(CC1C)CCN(C)C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C24H33N3O/c1-4-24(28)27(22-13-9-6-10-14-22)23-15-16-26(19-20(23)2)18-17-25(3)21-11-7-5-8-12-21/h5-14,20,23H,4,15-19H2,1-3H3
InChIKey
NRHZTBUXTIRERQ-UHFFFAOYSA-N
Compound name
N-[3-methyl-1-[2-(N-methylanilino)ethyl]piperidin-4-yl]-N-phenylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

379.26236 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 380.26964 196.5
[M+Na]+ 402.25158 197.1
[M-H]- 378.25508 205.3
[M+NH4]+ 397.29618 206.5
[M+K]+ 418.22552 193.9
[M+H-H2O]+ 362.25962 184.6
[M+HCOO]- 424.26056 215.4
[M+CH3COO]- 438.27621 231.6
[M+Na-2H]- 400.23703 195.6
[M]+ 379.26181 194.3
[M]- 379.26291 194.3
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.