[2,2,6,6-tetramethyl-1-[2-oxo-2-[2,2,6,6-tetramethyl-1-[2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)oxyethyl]piperidin-4-yl]oxyethyl]piperidin-4-yl] 2-aminoacetate

C33H60N4O6 — CID 23290422

IUPAC[2,2,6,6-tetramethyl-1-[2-oxo-2-[2,2,6,6-tetramethyl-1-[2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)oxyethyl]piperidin-4-yl]oxyethyl]piperidin-4-yl] 2-aminoacetate
SMILESCC1(C)CC(OC(=O)CN2C(C)(C)CC(OC(=O)CN3C(C)(C)CC(OC(=O)CN)CC3(C)C)CC2(C)C)CC(C)(C)N1
InChIInChI=1S/C33H60N4O6/c1-28(2)13-22(14-29(3,4)35-28)42-26(39)20-36-32(9,10)17-24(18-33(36,11)12)43-27(40)21-37-30(5,6)15-23(16-31(37,7)8)41-25(38)19-34/h22-24,35H,13-21,34H2,1-12H3
InChIKeyFVGNFOBUZUNCOZ-UHFFFAOYSA-N
MW608.87 g/mol
LogP3.93
Rot. Bonds8

About [2,2,6,6-tetramethyl-1-[2-oxo-2-[2,2,6,6-tetramethyl-1-[2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)oxyethyl]piperidin-4-yl]oxyethyl]piperidin-4-yl] 2-aminoacetate

[2,2,6,6-tetramethyl-1-[2-oxo-2-[2,2,6,6-tetramethyl-1-[2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)oxyethyl]piperidin-4-yl]oxyethyl]piperidin-4-yl] 2-aminoacetate (PubChem CID 23290422) has the molecular formula C33H60N4O6 and a molecular weight of 608.87 g/mol. Its IUPAC name is [2,2,6,6-tetramethyl-1-[2-oxo-2-[2,2,6,6-tetramethyl-1-[2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)oxyethyl]piperidin-4-yl]oxyethyl]piperidin-4-yl] 2-aminoacetate.

Molecular Properties

Compound Name[2,2,6,6-tetramethyl-1-[2-oxo-2-[2,2,6,6-tetramethyl-1-[2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)oxyethyl]piperidin-4-yl]oxyethyl]piperidin-4-yl] 2-aminoacetate
PubChem CID23290422
Molecular FormulaC33H60N4O6
Molecular Weight608.87 g/mol
Exact Mass608.45
IUPAC Name[2,2,6,6-tetramethyl-1-[2-oxo-2-[2,2,6,6-tetramethyl-1-[2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)oxyethyl]piperidin-4-yl]oxyethyl]piperidin-4-yl] 2-aminoacetate
SMILESCC1(C)CC(OC(=O)CN2C(C)(C)CC(OC(=O)CN3C(C)(C)CC(OC(=O)CN)CC3(C)C)CC2(C)C)CC(C)(C)N1
InChIInChI=1S/C33H60N4O6/c1-28(2)13-22(14-29(3,4)35-28)42-26(39)20-36-32(9,10)17-24(18-33(36,11)12)43-27(40)21-37-30(5,6)15-23(16-31(37,7)8)41-25(38)19-34/h22-24,35H,13-21,34H2,1-12H3
InChIKeyFVGNFOBUZUNCOZ-UHFFFAOYSA-N
XLogP3.93
TPSA123.43 Ų
H-Bond Donors2
H-Bond Acceptors10
Rotatable Bonds8
Heavy Atoms43
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500608.87
LogP ≤ 53.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}

Analyze [2,2,6,6-tetramethyl-1-[2-oxo-2-[2,2,6,6-tetramethyl-1-[2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)oxyethyl]piperidin-4-yl]oxyethyl]piperidin-4-yl] 2-aminoacetate with MolForge

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Frequently Asked Questions

What is the IUPAC name of [2,2,6,6-tetramethyl-1-[2-oxo-2-[2,2,6,6-tetramethyl-1-[2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)oxyethyl]piperidin-4-yl]oxyethyl]piperidin-4-yl] 2-aminoacetate?
The IUPAC name of [2,2,6,6-tetramethyl-1-[2-oxo-2-[2,2,6,6-tetramethyl-1-[2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)oxyethyl]piperidin-4-yl]oxyethyl]piperidin-4-yl] 2-aminoacetate (CID 23290422) is [2,2,6,6-tetramethyl-1-[2-oxo-2-[2,2,6,6-tetramethyl-1-[2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)oxyethyl]piperidin-4-yl]oxyethyl]piperidin-4-yl] 2-aminoacetate.
What is the SMILES notation for [2,2,6,6-tetramethyl-1-[2-oxo-2-[2,2,6,6-tetramethyl-1-[2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)oxyethyl]piperidin-4-yl]oxyethyl]piperidin-4-yl] 2-aminoacetate?
The canonical SMILES for [2,2,6,6-tetramethyl-1-[2-oxo-2-[2,2,6,6-tetramethyl-1-[2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)oxyethyl]piperidin-4-yl]oxyethyl]piperidin-4-yl] 2-aminoacetate is CC1(C)CC(OC(=O)CN2C(C)(C)CC(OC(=O)CN3C(C)(C)CC(OC(=O)CN)CC3(C)C)CC2(C)C)CC(C)(C)N1.
What is the InChIKey of [2,2,6,6-tetramethyl-1-[2-oxo-2-[2,2,6,6-tetramethyl-1-[2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)oxyethyl]piperidin-4-yl]oxyethyl]piperidin-4-yl] 2-aminoacetate?
The InChIKey is FVGNFOBUZUNCOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H60N4O6/c1-28(2)13-22(14-29(3,4)35-28)42-26(39)20-36-32(9,10)17-24(18-33(36,11)12)43-27(40)21-37-30(5,6)15-23(16-31(37,7)8)41-25(38)19-34/h22-24,35H,13-21,34H2,1-12H3.
What are the key properties of [2,2,6,6-tetramethyl-1-[2-oxo-2-[2,2,6,6-tetramethyl-1-[2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)oxyethyl]piperidin-4-yl]oxyethyl]piperidin-4-yl] 2-aminoacetate?
[2,2,6,6-tetramethyl-1-[2-oxo-2-[2,2,6,6-tetramethyl-1-[2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)oxyethyl]piperidin-4-yl]oxyethyl]piperidin-4-yl] 2-aminoacetate has a molecular weight of 608.87 g/mol, XLogP of 3.93, 8 rotatable bonds, 2 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for [2,2,6,6-tetramethyl-1-[2-oxo-2-[2,2,6,6-tetramethyl-1-[2-oxo-2-(2,2,6,6-tetramethylpiperidin-4-yl)oxyethyl]piperidin-4-yl]oxyethyl]piperidin-4-yl] 2-aminoacetate is sourced from PubChem (CID 23290422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).