2-[[4,6-bis[ethyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]oxy]ethanol

C27H51N7O2 — CID 14746200

IUPAC2-[[4,6-bis[ethyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]oxy]ethanol
SMILESCCN(c1nc(OCCO)nc(N(CC)C2CC(C)(C)NC(C)(C)C2)n1)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C27H51N7O2/c1-11-33(19-15-24(3,4)31-25(5,6)16-19)21-28-22(30-23(29-21)36-14-13-35)34(12-2)20-17-26(7,8)32-27(9,10)18-20/h19-20,31-32,35H,11-18H2,1-10H3
InChIKeyVUBXSLLRIQJUJP-UHFFFAOYSA-N
MW505.75 g/mol
LogP3.51
Rot. Bonds9

About 2-[[4,6-bis[ethyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]oxy]ethanol

2-[[4,6-bis[ethyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]oxy]ethanol (PubChem CID 14746200) has the molecular formula C27H51N7O2 and a molecular weight of 505.75 g/mol. Its IUPAC name is 2-[[4,6-bis[ethyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]oxy]ethanol.

Molecular Properties

Compound Name2-[[4,6-bis[ethyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]oxy]ethanol
PubChem CID14746200
Molecular FormulaC27H51N7O2
Molecular Weight505.75 g/mol
Exact Mass505.41
IUPAC Name2-[[4,6-bis[ethyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]oxy]ethanol
SMILESCCN(c1nc(OCCO)nc(N(CC)C2CC(C)(C)NC(C)(C)C2)n1)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C27H51N7O2/c1-11-33(19-15-24(3,4)31-25(5,6)16-19)21-28-22(30-23(29-21)36-14-13-35)34(12-2)20-17-26(7,8)32-27(9,10)18-20/h19-20,31-32,35H,11-18H2,1-10H3
InChIKeyVUBXSLLRIQJUJP-UHFFFAOYSA-N
XLogP3.51
TPSA98.67 Ų
H-Bond Donors3
H-Bond Acceptors9
Rotatable Bonds9
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500505.75
LogP ≤ 53.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 109

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Frequently Asked Questions

What is the IUPAC name of 2-[[4,6-bis[ethyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]oxy]ethanol?
The IUPAC name of 2-[[4,6-bis[ethyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]oxy]ethanol (CID 14746200) is 2-[[4,6-bis[ethyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]oxy]ethanol.
What is the SMILES notation for 2-[[4,6-bis[ethyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]oxy]ethanol?
The canonical SMILES for 2-[[4,6-bis[ethyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]oxy]ethanol is CCN(c1nc(OCCO)nc(N(CC)C2CC(C)(C)NC(C)(C)C2)n1)C1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of 2-[[4,6-bis[ethyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]oxy]ethanol?
The InChIKey is VUBXSLLRIQJUJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H51N7O2/c1-11-33(19-15-24(3,4)31-25(5,6)16-19)21-28-22(30-23(29-21)36-14-13-35)34(12-2)20-17-26(7,8)32-27(9,10)18-20/h19-20,31-32,35H,11-18H2,1-10H3.
What are the key properties of 2-[[4,6-bis[ethyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]oxy]ethanol?
2-[[4,6-bis[ethyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]oxy]ethanol has a molecular weight of 505.75 g/mol, XLogP of 3.51, 9 rotatable bonds, 3 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4,6-bis[ethyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]oxy]ethanol is sourced from PubChem (CID 14746200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).