CID 514966

1-methyl-5-oxo-n-phenyl-n-(3-piperidin-1-ylpropyl)pyrrolidine-3-carboxamide

Structural Information

Molecular Formula
C20H29N3O2
SMILES
CN1CC(CC1=O)C(=O)N(CCCN2CCCCC2)C3=CC=CC=C3
InChI
InChI=1S/C20H29N3O2/c1-21-16-17(15-19(21)24)20(25)23(18-9-4-2-5-10-18)14-8-13-22-11-6-3-7-12-22/h2,4-5,9-10,17H,3,6-8,11-16H2,1H3
InChIKey
SJYDOUOCIOWODD-UHFFFAOYSA-N
Compound name
1-methyl-5-oxo-N-phenyl-N-(3-piperidin-1-ylpropyl)pyrrolidine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

343.22598 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 344.23326 185.3
[M+Na]+ 366.21520 186.4
[M-H]- 342.21870 191.7
[M+NH4]+ 361.25980 196.9
[M+K]+ 382.18914 183.2
[M+H-H2O]+ 326.22324 174.4
[M+HCOO]- 388.22418 201.2
[M+CH3COO]- 402.23983 216.0
[M+Na-2H]- 364.20065 182.1
[M]+ 343.22543 180.5
[M]- 343.22653 180.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.