CID 3066980

1-piperazinecarboxamide, n-((dimethylamino)carbonyl)-n-methyl-4-(1-methylethyl)-, monohydrochloride

Structural Information

Molecular Formula
C12H24N4O2
SMILES
CC(C)N1CCN(CC1)C(=O)N(C)C(=O)N(C)C
InChI
InChI=1S/C12H24N4O2/c1-10(2)15-6-8-16(9-7-15)12(18)14(5)11(17)13(3)4/h10H,6-9H2,1-5H3
InChIKey
NYBMRHQHAQJENW-UHFFFAOYSA-N
Compound name
N-(dimethylcarbamoyl)-N-methyl-4-propan-2-ylpiperazine-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

256.1899 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.19718 162.7
[M+Na]+ 279.17912 165.5
[M-H]- 255.18262 165.4
[M+NH4]+ 274.22372 177.5
[M+K]+ 295.15306 167.4
[M+H-H2O]+ 239.18716 154.3
[M+HCOO]- 301.18810 180.4
[M+CH3COO]- 315.20375 207.2
[M+Na-2H]- 277.16457 161.7
[M]+ 256.18935 161.3
[M]- 256.19045 161.3
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