CID 3075528

1h-pyrido(3,4-b)indole-6-carboxamide, 2,3,4,9-tetrahydro-n-(3-(4-morpholinyl)propyl)-1-oxo-

Structural Information

Molecular Formula
C19H24N4O3
SMILES
C1CNC(=O)C2=C1C3=C(N2)C=CC(=C3)C(=O)NCCCN4CCOCC4
InChI
InChI=1S/C19H24N4O3/c24-18(20-5-1-7-23-8-10-26-11-9-23)13-2-3-16-15(12-13)14-4-6-21-19(25)17(14)22-16/h2-3,12,22H,1,4-11H2,(H,20,24)(H,21,25)
InChIKey
RKWPADTYZMVVCG-UHFFFAOYSA-N
Compound name
N-(3-morpholin-4-ylpropyl)-1-oxo-2,3,4,9-tetrahydropyrido[3,4-b]indole-6-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

356.18484 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 357.19212 183.0
[M+Na]+ 379.17406 187.0
[M-H]- 355.17756 184.2
[M+NH4]+ 374.21866 191.8
[M+K]+ 395.14800 181.4
[M+H-H2O]+ 339.18210 173.1
[M+HCOO]- 401.18304 193.1
[M+CH3COO]- 415.19869 189.8
[M+Na-2H]- 377.15951 184.7
[M]+ 356.18429 177.6
[M]- 356.18539 177.6
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.