CID 133107

179556-82-2

Structural Information

Molecular Formula
C20H27N3O
SMILES
CCOC1=C(N=CC=C1)N(C)C2CCN(CC2)CC3=CC=CC=C3
InChI
InChI=1S/C20H27N3O/c1-3-24-19-10-7-13-21-20(19)22(2)18-11-14-23(15-12-18)16-17-8-5-4-6-9-17/h4-10,13,18H,3,11-12,14-16H2,1-2H3
InChIKey
VNSBZWKWQFCKGO-UHFFFAOYSA-N
Compound name
N-(1-benzylpiperidin-4-yl)-3-ethoxy-N-methylpyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

17
Patents

325.21542 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.22270 181.4
[M+Na]+ 348.20464 195.1
[M+NH4]+ 343.24924 189.6
[M+K]+ 364.17858 186.3
[M-H]- 324.20814 188.1
[M+Na-2H]- 346.19009 191.1
[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

literature stripe

Patent stripe

patents stripe