CID 3071750

4-pyrimidinamine, n-cyclopropyl-2-(1h-imidazol-1-yl)-n-methyl-, monohydrochloride

Structural Information

Molecular Formula
C11H13N5
SMILES
CN(C1CC1)C2=NC(=NC=C2)N3C=CN=C3
InChI
InChI=1S/C11H13N5/c1-15(9-2-3-9)10-4-5-13-11(14-10)16-7-6-12-8-16/h4-9H,2-3H2,1H3
InChIKey
UTEVFJVVHRUIGF-UHFFFAOYSA-N
Compound name
N-cyclopropyl-2-imidazol-1-yl-N-methylpyrimidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

215.1171 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.12438 156.4
[M+Na]+ 238.10632 166.4
[M-H]- 214.10982 162.8
[M+NH4]+ 233.15092 166.7
[M+K]+ 254.08026 162.1
[M+H-H2O]+ 198.11436 145.8
[M+HCOO]- 260.11530 179.3
[M+CH3COO]- 274.13095 168.0
[M+Na-2H]- 236.09177 161.7
[M]+ 215.11655 158.7
[M]- 215.11765 158.7
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.