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 168.2
[M+Na]+ 298.18899 169.8
[M-H]- 274.19249 171.6
[M+NH4]+ 293.23359 180.9
[M+K]+ 314.16293 167.9
[M+H-H2O]+ 258.19703 158.0
[M+HCOO]- 320.19797 184.8
[M+CH3COO]- 334.21362 204.9
[M+Na-2H]- 296.17444 169.6
[M]+ 275.19922 164.6
[M]- 275.20032 164.6
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.