CID 3041501

Brn 0415638

Structural Information

Molecular Formula
C18H29N3O
SMILES
CCC(=O)N(CC(C)N1CCCC(C1)(C)C)C2=CC=CC=N2
InChI
InChI=1S/C18H29N3O/c1-5-17(22)21(16-9-6-7-11-19-16)13-15(2)20-12-8-10-18(3,4)14-20/h6-7,9,11,15H,5,8,10,12-14H2,1-4H3
InChIKey
OAGLNEUXPPFMIW-UHFFFAOYSA-N
Compound name
N-[2-(3,3-dimethylpiperidin-1-yl)propyl]-N-pyridin-2-ylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

303.23105 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.238326 176.1
[M+Na]+ 326.220268 178.8
[M-H]- 302.223774 179.9
[M+NH4]+ 321.264873 190.1
[M+K]+ 342.194208 177.0
[M+H-H2O]+ 286.228310 166.6
[M+HCOO]- 348.229251 192.1
[M+CH3COO]- 362.244901 211.5
[M+Na-2H]- 324.205716 176.9
[M]+ 303.23050142 174.0
[M]- 303.23159858 174.0
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.