CID 3063586

1-piperazinecarboxamide, 4-(2-quinolinyl)-, monohydrochloride

Structural Information

Molecular Formula
C14H16N4O
SMILES
C1CN(CCN1C2=NC3=CC=CC=C3C=C2)C(=O)N
InChI
InChI=1S/C14H16N4O/c15-14(19)18-9-7-17(8-10-18)13-6-5-11-3-1-2-4-12(11)16-13/h1-6H,7-10H2,(H2,15,19)
InChIKey
GQYOGWXVWRLALP-UHFFFAOYSA-N
Compound name
4-quinolin-2-ylpiperazine-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.13242 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.13970 159.2
[M+Na]+ 279.12164 172.1
[M+NH4]+ 274.16624 166.8
[M+K]+ 295.09558 165.4
[M-H]- 255.12514 162.6
[M+Na-2H]- 277.10709 166.1
[M]+ 256.13187 161.8
[M]- 256.13297 161.8
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.