CID 22367741

N-(3-fluorophenyl)-2-(piperazin-1-yl)propanamide

Structural Information

Molecular Formula
C13H18FN3O
SMILES
CC(C(=O)NC1=CC(=CC=C1)F)N2CCNCC2
InChI
InChI=1S/C13H18FN3O/c1-10(17-7-5-15-6-8-17)13(18)16-12-4-2-3-11(14)9-12/h2-4,9-10,15H,5-8H2,1H3,(H,16,18)
InChIKey
CRGIBILRUDDOAP-UHFFFAOYSA-N
Compound name
N-(3-fluorophenyl)-2-piperazin-1-ylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

251.14339 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 252.15067 158.7
[M+Na]+ 274.13261 167.9
[M+NH4]+ 269.17721 164.8
[M+K]+ 290.10655 162.6
[M-H]- 250.13611 159.5
[M+Na-2H]- 272.11806 163.7
[M]+ 251.14284 159.7
[M]- 251.14394 159.7
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.