CID 506609

Schembl17873924

Structural Information

Molecular Formula
C14H21N3O
SMILES
C1CCN(CC1)CCCNC(=O)C2=CN=CC=C2
InChI
InChI=1S/C14H21N3O/c18-14(13-6-4-7-15-12-13)16-8-5-11-17-9-2-1-3-10-17/h4,6-7,12H,1-3,5,8-11H2,(H,16,18)
InChIKey
FAXQQQWOLVINSQ-UHFFFAOYSA-N
Compound name
N-(3-piperidin-1-ylpropyl)pyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

247.16846 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 248.17574 159.2
[M+Na]+ 270.15768 161.7
[M-H]- 246.16118 161.3
[M+NH4]+ 265.20228 172.5
[M+K]+ 286.13162 158.5
[M+H-H2O]+ 230.16572 149.3
[M+HCOO]- 292.16666 177.0
[M+CH3COO]- 306.18231 194.6
[M+Na-2H]- 268.14313 163.6
[M]+ 247.16791 154.2
[M]- 247.16901 154.2
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