CID 33933

N-(2-picolyl)-n-(4-methoxyphenyl)-n-(2-piperidinoethyl)amine hydrochloride

Structural Information

Molecular Formula
C20H27N3O
SMILES
COC1=CC=C(C=C1)N(CCN2CCCCC2)CC3=CC=CC=N3
InChI
InChI=1S/C20H27N3O/c1-24-20-10-8-19(9-11-20)23(17-18-7-3-4-12-21-18)16-15-22-13-5-2-6-14-22/h3-4,7-12H,2,5-6,13-17H2,1H3
InChIKey
NOKCMSYGBLCGGZ-UHFFFAOYSA-N
Compound name
4-methoxy-N-(2-piperidin-1-ylethyl)-N-(pyridin-2-ylmethyl)aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

325.21542 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.22270 181.5
[M+Na]+ 348.20464 194.8
[M+NH4]+ 343.24924 189.6
[M+K]+ 364.17858 185.8
[M-H]- 324.20814 188.1
[M+Na-2H]- 346.19009 191.4
[M]+ 325.21487 185.3
[M]- 325.21597 185.3
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.