CID 18698214

1-(4-methylpiperazine-1-carbonyl)cyclopentan-1-amine dihydrochloride

Structural Information

Molecular Formula
C11H21N3O
SMILES
CN1CCN(CC1)C(=O)C2(CCCC2)N
InChI
InChI=1S/C11H21N3O/c1-13-6-8-14(9-7-13)10(15)11(12)4-2-3-5-11/h2-9,12H2,1H3
InChIKey
CAAHQFGUQKPIQL-UHFFFAOYSA-N
Compound name
(1-aminocyclopentyl)-(4-methylpiperazin-1-yl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

31
Patents

211.16846 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.17574 151.2
[M+Na]+ 234.15768 155.0
[M-H]- 210.16118 153.6
[M+NH4]+ 229.20228 170.0
[M+K]+ 250.13162 153.2
[M+H-H2O]+ 194.16572 143.4
[M+HCOO]- 256.16666 167.4
[M+CH3COO]- 270.18231 186.4
[M+Na-2H]- 232.14313 151.9
[M]+ 211.16791 142.9
[M]- 211.16901 142.9
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