N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)-4-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-6-phenoxy-1,3,5-triazin-2-amine

C27H42N6O4 — CID 90992312

IUPACN-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)-4-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-6-phenoxy-1,3,5-triazin-2-amine
SMILESCC1(C)CC(Nc2nc(Oc3ccccc3)nc(OC3CC(C)(C)N(O)C(C)(C)C3)n2)CC(C)(C)N1O
InChIInChI=1S/C27H42N6O4/c1-24(2)14-18(15-25(3,4)32(24)34)28-21-29-22(36-19-12-10-9-11-13-19)31-23(30-21)37-20-16-26(5,6)33(35)27(7,8)17-20/h9-13,18,20,34-35H,14-17H2,1-8H3,(H,28,29,30,31)
InChIKeyCJTNKVJXCKRNSK-UHFFFAOYSA-N
MW514.67 g/mol
LogP5.28
Rot. Bonds6

About N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)-4-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-6-phenoxy-1,3,5-triazin-2-amine

N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)-4-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-6-phenoxy-1,3,5-triazin-2-amine (PubChem CID 90992312) has the molecular formula C27H42N6O4 and a molecular weight of 514.67 g/mol. Its IUPAC name is N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)-4-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-6-phenoxy-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)-4-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-6-phenoxy-1,3,5-triazin-2-amine
PubChem CID90992312
Molecular FormulaC27H42N6O4
Molecular Weight514.67 g/mol
Exact Mass514.33
IUPAC NameN-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)-4-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-6-phenoxy-1,3,5-triazin-2-amine
SMILESCC1(C)CC(Nc2nc(Oc3ccccc3)nc(OC3CC(C)(C)N(O)C(C)(C)C3)n2)CC(C)(C)N1O
InChIInChI=1S/C27H42N6O4/c1-24(2)14-18(15-25(3,4)32(24)34)28-21-29-22(36-19-12-10-9-11-13-19)31-23(30-21)37-20-16-26(5,6)33(35)27(7,8)17-20/h9-13,18,20,34-35H,14-17H2,1-8H3,(H,28,29,30,31)
InChIKeyCJTNKVJXCKRNSK-UHFFFAOYSA-N
XLogP5.28
TPSA116.10 Ų
H-Bond Donors3
H-Bond Acceptors10
Rotatable Bonds6
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500514.67
LogP ≤ 55.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1010

Analyze N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)-4-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-6-phenoxy-1,3,5-triazin-2-amine with MolForge

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Launch Full Analysis

Related Compounds

4-N,4-N-diethyl-6-(4-morpholin-4-ylpiperidin-1-yl)-2-N-(2-phenoxyethyl)-1,3,5-triazine-2,4-diamine
CID 117088330
4-N,4-N-diethyl-2-N-[2-(4-methoxyphenyl)ethyl]-6-(4-morpholin-4-ylpiperidin-1-yl)-1,3,5-triazine-2,4-diamine
CID 117088808
2,4-Diphenoxy-6-(2,2,6,6-tetramethylpiperidin-4-yl)oxy-1,3,5-triazine
CID 20574159
CID 59482344
CID 59482344
CID 59482350
CID 59482350
CID 59482428
CID 59482428
CID 59482502
CID 59482502
CID 59482513
CID 59482513
2,2,6,6-Tetramethyl-1-[4-phenoxy-6-(2,2,6,6-tetramethylpiperidin-1-yl)-1,3,5-triazin-2-yl]piperidin-4-amine
CID 68118767
2,2,6,6-Tetramethyl-1-[4-(2-methylphenoxy)-6-(2,2,6,6-tetramethylpiperidin-1-yl)-1,3,5-triazin-2-yl]piperidin-4-amine
CID 68119863
1-[4-(4-Tert-butylphenoxy)-6-(2,2,6,6-tetramethylpiperidin-1-yl)-1,3,5-triazin-2-yl]-2,2,6,6-tetramethylpiperidin-4-amine
CID 68119957
1-[4-(4-Dodecylphenoxy)-6-(2,2,6,6-tetramethylpiperidin-1-yl)-1,3,5-triazin-2-yl]-2,2,6,6-tetramethylpiperidin-4-amine
CID 68120060

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)-4-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-6-phenoxy-1,3,5-triazin-2-amine?
The IUPAC name of N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)-4-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-6-phenoxy-1,3,5-triazin-2-amine (CID 90992312) is N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)-4-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-6-phenoxy-1,3,5-triazin-2-amine.
What is the SMILES notation for N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)-4-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-6-phenoxy-1,3,5-triazin-2-amine?
The canonical SMILES for N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)-4-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-6-phenoxy-1,3,5-triazin-2-amine is CC1(C)CC(Nc2nc(Oc3ccccc3)nc(OC3CC(C)(C)N(O)C(C)(C)C3)n2)CC(C)(C)N1O.
What is the InChIKey of N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)-4-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-6-phenoxy-1,3,5-triazin-2-amine?
The InChIKey is CJTNKVJXCKRNSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H42N6O4/c1-24(2)14-18(15-25(3,4)32(24)34)28-21-29-22(36-19-12-10-9-11-13-19)31-23(30-21)37-20-16-26(5,6)33(35)27(7,8)17-20/h9-13,18,20,34-35H,14-17H2,1-8H3,(H,28,29,30,31).
What are the key properties of N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)-4-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-6-phenoxy-1,3,5-triazin-2-amine?
N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)-4-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-6-phenoxy-1,3,5-triazin-2-amine has a molecular weight of 514.67 g/mol, XLogP of 5.28, 6 rotatable bonds, 3 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)-4-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-6-phenoxy-1,3,5-triazin-2-amine is sourced from PubChem (CID 90992312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).