CID 212620

Brn 0430667

Structural Information

Molecular Formula
C19H29N3O
SMILES
CCC(=O)N(C1=CC=CC=N1)C(C)CN2CC3CCCC(C3)C2
InChI
InChI=1S/C19H29N3O/c1-3-19(23)22(18-9-4-5-10-20-18)15(2)12-21-13-16-7-6-8-17(11-16)14-21/h4-5,9-10,15-17H,3,6-8,11-14H2,1-2H3
InChIKey
ZJXQHXGNCYRTOI-UHFFFAOYSA-N
Compound name
N-[1-(3-azabicyclo[3.3.1]nonan-3-yl)propan-2-yl]-N-pyridin-2-ylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

315.23105 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 316.23833 178.2
[M+Na]+ 338.22027 188.1
[M+NH4]+ 333.26487 186.1
[M+K]+ 354.19421 181.2
[M-H]- 314.22377 181.2
[M+Na-2H]- 336.20572 182.1
[M]+ 315.23050 180.2
[M]- 315.23160 180.2
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.