CID 215397

N-(1-(2-(1h-indol-3-yl)ethyl)-4-piperidinyl)tricyclo(3.3.1.1(sup 3,7))decane-1-carboxamide hcl

Structural Information

Molecular Formula
C26H35N3O
SMILES
C1CN(CCC1NC(=O)C23CC4CC(C2)CC(C4)C3)CCC5=CNC6=CC=CC=C65
InChI
InChI=1S/C26H35N3O/c30-25(26-14-18-11-19(15-26)13-20(12-18)16-26)28-22-6-9-29(10-7-22)8-5-21-17-27-24-4-2-1-3-23(21)24/h1-4,17-20,22,27H,5-16H2,(H,28,30)
InChIKey
MMNHYCCLGCBSGL-UHFFFAOYSA-N
Compound name
N-[1-[2-(1H-indol-3-yl)ethyl]piperidin-4-yl]adamantane-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

405.278 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 406.28528 184.6
[M+Na]+ 428.26722 182.4
[M-H]- 404.27072 181.1
[M+NH4]+ 423.31182 200.0
[M+K]+ 444.24116 175.1
[M+H-H2O]+ 388.27526 172.2
[M+HCOO]- 450.27620 184.0
[M+CH3COO]- 464.29185 187.8
[M+Na-2H]- 426.25267 188.9
[M]+ 405.27745 179.3
[M]- 405.27855 179.3
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.