CID 3041458

Brn 0485058

Structural Information

Molecular Formula
C16H25N3O
SMILES
CCC(=O)N(C1=CN=CC=C1)C(C)CN2CCCCC2
InChI
InChI=1S/C16H25N3O/c1-3-16(20)19(15-8-7-9-17-12-15)14(2)13-18-10-5-4-6-11-18/h7-9,12,14H,3-6,10-11,13H2,1-2H3
InChIKey
HPHNPOGWFJDPMM-UHFFFAOYSA-N
Compound name
N-(1-piperidin-1-ylpropan-2-yl)-N-pyridin-3-ylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

275.19977 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.20705 167.8
[M+Na]+ 298.18899 177.8
[M+NH4]+ 293.23359 174.8
[M+K]+ 314.16293 171.8
[M-H]- 274.19249 170.9
[M+Na-2H]- 296.17444 174.1
[M]+ 275.19922 169.8
[M]- 275.20032 169.8
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.