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]+ 256.14444 162.2
[M+Na]+ 278.12638 172.1
[M-H]- 254.12988 170.1
[M+NH4]+ 273.17098 171.7
[M+K]+ 294.10032 166.8
[M+H-H2O]+ 238.13442 152.7
[M+HCOO]- 300.13536 185.6
[M+CH3COO]- 314.15101 173.7
[M+Na-2H]- 276.11183 168.0
[M]+ 255.13661 165.3
[M]- 255.13771 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.