CID 3066961

1-piperazinecarboxamide, 4-(3,5-dichlorophenyl)-n-((dimethylamino)carbonyl)-n-methyl-, monohydrochloride

Structural Information

Molecular Formula
C15H20Cl2N4O2
SMILES
CN(C)C(=O)N(C)C(=O)N1CCN(CC1)C2=CC(=CC(=C2)Cl)Cl
InChI
InChI=1S/C15H20Cl2N4O2/c1-18(2)14(22)19(3)15(23)21-6-4-20(5-7-21)13-9-11(16)8-12(17)10-13/h8-10H,4-7H2,1-3H3
InChIKey
KGWZPYSVCLRBSC-UHFFFAOYSA-N
Compound name
4-(3,5-dichlorophenyl)-N-(dimethylcarbamoyl)-N-methylpiperazine-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

358.09634 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 359.10362 180.1
[M+Na]+ 381.08556 185.8
[M-H]- 357.08906 185.6
[M+NH4]+ 376.13016 192.2
[M+K]+ 397.05950 182.8
[M+H-H2O]+ 341.09360 171.8
[M+HCOO]- 403.09454 189.6
[M+CH3COO]- 417.11019 220.9
[M+Na-2H]- 379.07101 178.9
[M]+ 358.09579 182.1
[M]- 358.09689 182.1
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.