CID 3024949

N-(3-methyl-1-(2-(4-thiazolyl)ethyl)-4-piperidinyl)-n-phenylpropanamide

Structural Information

Molecular Formula
C20H27N3OS
SMILES
CCC(=O)N(C1CCN(CC1C)CCC2=CSC=N2)C3=CC=CC=C3
InChI
InChI=1S/C20H27N3OS/c1-3-20(24)23(18-7-5-4-6-8-18)19-10-12-22(13-16(19)2)11-9-17-14-25-15-21-17/h4-8,14-16,19H,3,9-13H2,1-2H3
InChIKey
CABCXKKEYBMKPB-UHFFFAOYSA-N
Compound name
N-[3-methyl-1-[2-(1,3-thiazol-4-yl)ethyl]piperidin-4-yl]-N-phenylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

357.18747 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 358.19475 185.4
[M+Na]+ 380.17669 196.2
[M+NH4]+ 375.22129 193.2
[M+K]+ 396.15063 188.7
[M-H]- 356.18019 190.8
[M+Na-2H]- 378.16214 192.5
[M]+ 357.18692 188.8
[M]- 357.18802 188.8
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.