CID 954514

N-[4-(4-methylpiperidin-1-yl)phenyl]propanamide

Structural Information

Molecular Formula
C15H22N2O
SMILES
CCC(=O)NC1=CC=C(C=C1)N2CCC(CC2)C
InChI
InChI=1S/C15H22N2O/c1-3-15(18)16-13-4-6-14(7-5-13)17-10-8-12(2)9-11-17/h4-7,12H,3,8-11H2,1-2H3,(H,16,18)
InChIKey
NEGGFIVADCVCCU-UHFFFAOYSA-N
Compound name
N-[4-(4-methylpiperidin-1-yl)phenyl]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

246.17322 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.18050 159.6
[M+Na]+ 269.16244 163.7
[M-H]- 245.16594 163.9
[M+NH4]+ 264.20704 175.1
[M+K]+ 285.13638 160.5
[M+H-H2O]+ 229.17048 151.2
[M+HCOO]- 291.17142 178.5
[M+CH3COO]- 305.18707 197.2
[M+Na-2H]- 267.14789 161.9
[M]+ 246.17267 155.3
[M]- 246.17377 155.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.