CID 3073367

4-piperidinol, 1-(4-(cyclopropylamino)-6-propyl-1,3,5-triazin-2-yl)-

Structural Information

Molecular Formula
C14H23N5O
SMILES
CCCC1=NC(=NC(=N1)N2CCC(CC2)O)NC3CC3
InChI
InChI=1S/C14H23N5O/c1-2-3-12-16-13(15-10-4-5-10)18-14(17-12)19-8-6-11(20)7-9-19/h10-11,20H,2-9H2,1H3,(H,15,16,17,18)
InChIKey
OCADGCCKLKOBMI-UHFFFAOYSA-N
Compound name
1-[4-(cyclopropylamino)-6-propyl-1,3,5-triazin-2-yl]piperidin-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

277.19025 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.19753 168.0
[M+Na]+ 300.17947 180.8
[M+NH4]+ 295.22407 174.8
[M+K]+ 316.15341 176.0
[M-H]- 276.18297 177.7
[M+Na-2H]- 298.16492 176.6
[M]+ 277.18970 173.4
[M]- 277.19080 173.4
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.