2,4-diphenoxy-6-(2,2,6,6-tetramethylpiperidin-4-yl)oxy-1,3,5-triazine

C24H28N4O3 — CID 20574159

IUPAC2,4-diphenoxy-6-(2,2,6,6-tetramethylpiperidin-4-yl)oxy-1,3,5-triazine
SMILESCC1(C)CC(Oc2nc(Oc3ccccc3)nc(Oc3ccccc3)n2)CC(C)(C)N1
InChIInChI=1S/C24H28N4O3/c1-23(2)15-19(16-24(3,4)28-23)31-22-26-20(29-17-11-7-5-8-12-17)25-21(27-22)30-18-13-9-6-10-14-18/h5-14,19,28H,15-16H2,1-4H3
InChIKeyOBQIYFOXONIUNK-UHFFFAOYSA-N
MW420.51 g/mol
LogP5.14
Rot. Bonds6

About 2,4-diphenoxy-6-(2,2,6,6-tetramethylpiperidin-4-yl)oxy-1,3,5-triazine

2,4-diphenoxy-6-(2,2,6,6-tetramethylpiperidin-4-yl)oxy-1,3,5-triazine (PubChem CID 20574159) has the molecular formula C24H28N4O3 and a molecular weight of 420.51 g/mol. Its IUPAC name is 2,4-diphenoxy-6-(2,2,6,6-tetramethylpiperidin-4-yl)oxy-1,3,5-triazine.

Molecular Properties

Compound Name2,4-diphenoxy-6-(2,2,6,6-tetramethylpiperidin-4-yl)oxy-1,3,5-triazine
PubChem CID20574159
Molecular FormulaC24H28N4O3
Molecular Weight420.51 g/mol
Exact Mass420.22
IUPAC Name2,4-diphenoxy-6-(2,2,6,6-tetramethylpiperidin-4-yl)oxy-1,3,5-triazine
SMILESCC1(C)CC(Oc2nc(Oc3ccccc3)nc(Oc3ccccc3)n2)CC(C)(C)N1
InChIInChI=1S/C24H28N4O3/c1-23(2)15-19(16-24(3,4)28-23)31-22-26-20(29-17-11-7-5-8-12-17)25-21(27-22)30-18-13-9-6-10-14-18/h5-14,19,28H,15-16H2,1-4H3
InChIKeyOBQIYFOXONIUNK-UHFFFAOYSA-N
XLogP5.14
TPSA78.39 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500420.51
LogP ≤ 55.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2,4-diphenoxy-6-(2,2,6,6-tetramethylpiperidin-4-yl)oxy-1,3,5-triazine?
The IUPAC name of 2,4-diphenoxy-6-(2,2,6,6-tetramethylpiperidin-4-yl)oxy-1,3,5-triazine (CID 20574159) is 2,4-diphenoxy-6-(2,2,6,6-tetramethylpiperidin-4-yl)oxy-1,3,5-triazine.
What is the SMILES notation for 2,4-diphenoxy-6-(2,2,6,6-tetramethylpiperidin-4-yl)oxy-1,3,5-triazine?
The canonical SMILES for 2,4-diphenoxy-6-(2,2,6,6-tetramethylpiperidin-4-yl)oxy-1,3,5-triazine is CC1(C)CC(Oc2nc(Oc3ccccc3)nc(Oc3ccccc3)n2)CC(C)(C)N1.
What is the InChIKey of 2,4-diphenoxy-6-(2,2,6,6-tetramethylpiperidin-4-yl)oxy-1,3,5-triazine?
The InChIKey is OBQIYFOXONIUNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N4O3/c1-23(2)15-19(16-24(3,4)28-23)31-22-26-20(29-17-11-7-5-8-12-17)25-21(27-22)30-18-13-9-6-10-14-18/h5-14,19,28H,15-16H2,1-4H3.
What are the key properties of 2,4-diphenoxy-6-(2,2,6,6-tetramethylpiperidin-4-yl)oxy-1,3,5-triazine?
2,4-diphenoxy-6-(2,2,6,6-tetramethylpiperidin-4-yl)oxy-1,3,5-triazine has a molecular weight of 420.51 g/mol, XLogP of 5.14, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-diphenoxy-6-(2,2,6,6-tetramethylpiperidin-4-yl)oxy-1,3,5-triazine is sourced from PubChem (CID 20574159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).