CID 45787581

2-cyclopentylpyrimidin-4-amine

Structural Information

Molecular Formula
C9H13N3
SMILES
C1CCC(C1)C2=NC=CC(=N2)N
InChI
InChI=1S/C9H13N3/c10-8-5-6-11-9(12-8)7-3-1-2-4-7/h5-7H,1-4H2,(H2,10,11,12)
InChIKey
AJHXQZJGACQEDX-UHFFFAOYSA-N
Compound name
2-cyclopentylpyrimidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

163.11095 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.11823 135.3
[M+Na]+ 186.10017 146.7
[M+NH4]+ 181.14477 144.0
[M+K]+ 202.07411 142.2
[M-H]- 162.10367 138.6
[M+Na-2H]- 184.08562 142.7
[M]+ 163.11040 137.6
[M]- 163.11150 137.6
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