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]+ 216.124376 156.4
[M+Na]+ 238.106318 166.4
[M-H]- 214.109824 162.8
[M+NH4]+ 233.150923 166.7
[M+K]+ 254.080258 162.1
[M+H-H2O]+ 198.114360 145.8
[M+HCOO]- 260.115301 179.3
[M+CH3COO]- 274.130951 168.0
[M+Na-2H]- 236.091766 161.7
[M]+ 215.11655142 158.7
[M]- 215.11764858 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.