CID 47003026

1-[2-(pyridin-4-yl)ethyl]piperidin-4-amine

Structural Information

Molecular Formula
C12H19N3
SMILES
C1CN(CCC1N)CCC2=CC=NC=C2
InChI
InChI=1S/C12H19N3/c13-12-4-9-15(10-5-12)8-3-11-1-6-14-7-2-11/h1-2,6-7,12H,3-5,8-10,13H2
InChIKey
YGMSGHHKUDNZRE-UHFFFAOYSA-N
Compound name
1-(2-pyridin-4-ylethyl)piperidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

205.1579 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.16518 148.6
[M+Na]+ 228.14712 153.1
[M-H]- 204.15062 150.9
[M+NH4]+ 223.19172 163.9
[M+K]+ 244.12106 149.4
[M+H-H2O]+ 188.15516 139.4
[M+HCOO]- 250.15610 167.0
[M+CH3COO]- 264.17175 187.7
[M+Na-2H]- 226.13257 153.4
[M]+ 205.15735 142.3
[M]- 205.15845 142.3
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

patents stripe