CID 213626

Brn 0501072

Structural Information

Molecular Formula
C24H26N4O
SMILES
C1CN(CCC1NC(=O)C2=CNC3=CC=CC=C32)CCC4=CNC5=CC=CC=C54
InChI
InChI=1S/C24H26N4O/c29-24(21-16-26-23-8-4-2-6-20(21)23)27-18-10-13-28(14-11-18)12-9-17-15-25-22-7-3-1-5-19(17)22/h1-8,15-16,18,25-26H,9-14H2,(H,27,29)
InChIKey
IXMAEAMKSUUGOF-UHFFFAOYSA-N
Compound name
N-[1-[2-(1H-indol-3-yl)ethyl]piperidin-4-yl]-1H-indole-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

386.21066 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 387.21794 189.7
[M+Na]+ 409.19988 195.3
[M-H]- 385.20338 194.9
[M+NH4]+ 404.24448 200.5
[M+K]+ 425.17382 186.6
[M+H-H2O]+ 369.20792 179.4
[M+HCOO]- 431.20886 205.1
[M+CH3COO]- 445.22451 197.5
[M+Na-2H]- 407.18533 190.5
[M]+ 386.21011 186.1
[M]- 386.21121 186.1
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

patents stripe