CID 22832052

1h-indole, 1-[1-(2-pyridinylmethyl)-4-piperidinyl]-

Structural Information

Molecular Formula
C19H21N3
SMILES
C1CN(CCC1N2C=CC3=CC=CC=C32)CC4=CC=CC=N4
InChI
InChI=1S/C19H21N3/c1-2-7-19-16(5-1)8-14-22(19)18-9-12-21(13-10-18)15-17-6-3-4-11-20-17/h1-8,11,14,18H,9-10,12-13,15H2
InChIKey
MGBMPPPTIOOZPR-UHFFFAOYSA-N
Compound name
1-[1-(pyridin-2-ylmethyl)piperidin-4-yl]indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

291.17355 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.18083 169.7
[M+Na]+ 314.16277 176.5
[M-H]- 290.16627 175.4
[M+NH4]+ 309.20737 183.0
[M+K]+ 330.13671 169.7
[M+H-H2O]+ 274.17081 158.2
[M+HCOO]- 336.17175 187.1
[M+CH3COO]- 350.18740 179.6
[M+Na-2H]- 312.14822 173.6
[M]+ 291.17300 166.5
[M]- 291.17410 166.5
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