CID 98557

Piperidine, 1-(3-amino-2-pyridyl)-4-phenyl-

Structural Information

Molecular Formula
C16H19N3
SMILES
C1CN(CCC1C2=CC=CC=C2)C3=C(C=CC=N3)N
InChI
InChI=1S/C16H19N3/c17-15-7-4-10-18-16(15)19-11-8-14(9-12-19)13-5-2-1-3-6-13/h1-7,10,14H,8-9,11-12,17H2
InChIKey
SYNLRHKAAZZRKZ-UHFFFAOYSA-N
Compound name
2-(4-phenylpiperidin-1-yl)pyridin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

253.1579 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.165176 160.2
[M+Na]+ 276.147118 165.2
[M-H]- 252.150624 165.7
[M+NH4]+ 271.191723 173.2
[M+K]+ 292.121058 159.7
[M+H-H2O]+ 236.155160 149.7
[M+HCOO]- 298.156101 178.6
[M+CH3COO]- 312.171751 170.2
[M+Na-2H]- 274.132566 164.7
[M]+ 253.15735142 153.1
[M]- 253.15844858 153.1
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

No patent data available for this compound.