CID 64296181

N-cyclopropyl-5-(4-methoxyphenyl)-4-methylpyrimidin-2-amine

Structural Information

Molecular Formula
C15H17N3O
SMILES
CC1=NC(=NC=C1C2=CC=C(C=C2)OC)NC3CC3
InChI
InChI=1S/C15H17N3O/c1-10-14(11-3-7-13(19-2)8-4-11)9-16-15(17-10)18-12-5-6-12/h3-4,7-9,12H,5-6H2,1-2H3,(H,16,17,18)
InChIKey
LXYNXCWMABOJOE-UHFFFAOYSA-N
Compound name
N-cyclopropyl-5-(4-methoxyphenyl)-4-methylpyrimidin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

255.13716 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.144436 162.2
[M+Na]+ 278.126378 172.1
[M-H]- 254.129884 170.1
[M+NH4]+ 273.170983 171.7
[M+K]+ 294.100318 166.8
[M+H-H2O]+ 238.134420 152.7
[M+HCOO]- 300.135361 185.6
[M+CH3COO]- 314.151011 173.7
[M+Na-2H]- 276.111826 168.0
[M]+ 255.13661142 165.3
[M]- 255.13770858 165.3
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.