CID 212619

24606-50-6

Structural Information

Molecular Formula
C17H25N3O
SMILES
CCC(=O)N(C1=CC=CC=N1)C(C)CN2CC3CCC3C2
InChI
InChI=1S/C17H25N3O/c1-3-17(21)20(16-6-4-5-9-18-16)13(2)10-19-11-14-7-8-15(14)12-19/h4-6,9,13-15H,3,7-8,10-12H2,1-2H3
InChIKey
FNICGOJATFUBFY-UHFFFAOYSA-N
Compound name
N-[1-(3-azabicyclo[3.2.0]heptan-3-yl)propan-2-yl]-N-pyridin-2-ylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

287.19977 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.207046 171.9
[M+Na]+ 310.188988 173.9
[M-H]- 286.192494 176.6
[M+NH4]+ 305.233593 180.9
[M+K]+ 326.162928 175.0
[M+H-H2O]+ 270.197030 157.3
[M+HCOO]- 332.197971 188.3
[M+CH3COO]- 346.213621 210.8
[M+Na-2H]- 308.174436 171.2
[M]+ 287.19922142 179.5
[M]- 287.20031858 179.5
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.