CID 3073363

2-cyclopropylamino-4-(2-methylcyclopropyl)-6-morpholino-1,3,5-triazine hydrochloride

Structural Information

Molecular Formula
C14H21N5O
SMILES
CC1CC1C2=NC(=NC(=N2)N3CCOCC3)NC4CC4
InChI
InChI=1S/C14H21N5O/c1-9-8-11(9)12-16-13(15-10-2-3-10)18-14(17-12)19-4-6-20-7-5-19/h9-11H,2-8H2,1H3,(H,15,16,17,18)
InChIKey
OFAKYZBCQJOPLQ-UHFFFAOYSA-N
Compound name
N-cyclopropyl-4-(2-methylcyclopropyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

32
Patents

275.17462 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.18190 192.1
[M+Na]+ 298.16384 198.8
[M-H]- 274.16734 198.7
[M+NH4]+ 293.20844 191.2
[M+K]+ 314.13778 194.8
[M+H-H2O]+ 258.17188 181.8
[M+HCOO]- 320.17282 205.9
[M+CH3COO]- 334.18847 198.0
[M+Na-2H]- 296.14929 192.2
[M]+ 275.17407 192.1
[M]- 275.17517 192.1
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