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

30
Patents

211.16846 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.175736 151.2
[M+Na]+ 234.157678 155.0
[M-H]- 210.161184 153.6
[M+NH4]+ 229.202283 170.0
[M+K]+ 250.131618 153.2
[M+H-H2O]+ 194.165720 143.4
[M+HCOO]- 256.166661 167.4
[M+CH3COO]- 270.182311 186.4
[M+Na-2H]- 232.143126 151.9
[M]+ 211.16791142 142.9
[M]- 211.16900858 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