CID 3066954

1-piperazinecarboxamide, n-((dimethylamino)carbonyl)-4-(4-methoxyphenyl)-n-methyl-

Structural Information

Molecular Formula
C16H24N4O3
SMILES
CN(C)C(=O)N(C)C(=O)N1CCN(CC1)C2=CC=C(C=C2)OC
InChI
InChI=1S/C16H24N4O3/c1-17(2)15(21)18(3)16(22)20-11-9-19(10-12-20)13-5-7-14(23-4)8-6-13/h5-8H,9-12H2,1-4H3
InChIKey
ZIDDXFYEFIFTNI-UHFFFAOYSA-N
Compound name
N-(dimethylcarbamoyl)-4-(4-methoxyphenyl)-N-methylpiperazine-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

320.18484 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 321.19212 176.3
[M+Na]+ 343.17406 179.4
[M-H]- 319.17756 182.2
[M+NH4]+ 338.21866 188.2
[M+K]+ 359.14800 179.8
[M+H-H2O]+ 303.18210 166.1
[M+HCOO]- 365.18304 195.2
[M+CH3COO]- 379.19869 217.3
[M+Na-2H]- 341.15951 176.5
[M]+ 320.18429 176.1
[M]- 320.18539 176.1
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.