(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl) 2-[2-[2-[bis[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]acetate

C151H282N8O15 — CID 54048127

IUPAC(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl) 2-[2-[2-[bis[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]acetate
SMILESCCCCCCCCCCCCCCCCCC(=O)N1C(C)(C)CC(OC(=O)CN(CC(=O)OC2CC(C)(C)N(C(=O)CCCCCCCCCCCCCCCCC)C(C)(C)C2)CC(C)N(CC(=O)OC2CC(C)(C)N(C(=O)CCCCCCCCCCCCCCCCC)C(C)(C)C2)CC(C)N(CC(=O)OC2CC(C)(C)N(C(=O)CCCCCCCCCCCCCCCCC)C(C)(C)C2)CC(=O)OC2CC(C)(C)N(C(=O)CCCCCCCCCCCCCCCCC)C(C)(C)C2)CC1(C)C
InChIInChI=1S/C151H282N8O15/c1-28-33-38-43-48-53-58-63-68-73-78-83-88-93-98-103-132(160)155-142(8,9)108-127(109-143(155,10)11)170-137(165)120-152(121-138(166)171-128-110-144(12,13)156(145(14,15)111-128)133(161)104-99-94-89-84-79-74-69-64-59-54-49-44-39-34-29-2)118-125(6)153(122-139(167)172-129-112-146(16,17)157(147(18,19)113-129)134(162)105-100-95-90-85-80-75-70-65-60-55-50-45-40-35-30-3)119-126(7)154(123-140(168)173-130-114-148(20,21)158(149(22,23)115-130)135(163)106-101-96-91-86-81-76-71-66-61-56-51-46-41-36-31-4)124-141(169)174-131-116-150(24,25)159(151(26,27)117-131)136(164)107-102-97-92-87-82-77-72-67-62-57-52-47-42-37-32-5/h125-131H,28-124H2,1-27H3
InChIKeyLQYYJTXDIJDQPF-UHFFFAOYSA-N
MW2449.96 g/mol
LogP39.43
Rot. Bonds101

About (2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl) 2-[2-[2-[bis[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]acetate

(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl) 2-[2-[2-[bis[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]acetate (PubChem CID 54048127) has the molecular formula C151H282N8O15 and a molecular weight of 2449.96 g/mol. Its IUPAC name is (2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl) 2-[2-[2-[bis[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]acetate.

Molecular Properties

Compound Name(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl) 2-[2-[2-[bis[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]acetate
PubChem CID54048127
Molecular FormulaC151H282N8O15
Molecular Weight2449.96 g/mol
Exact Mass2448.15
IUPAC Name(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl) 2-[2-[2-[bis[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]acetate
SMILESCCCCCCCCCCCCCCCCCC(=O)N1C(C)(C)CC(OC(=O)CN(CC(=O)OC2CC(C)(C)N(C(=O)CCCCCCCCCCCCCCCCC)C(C)(C)C2)CC(C)N(CC(=O)OC2CC(C)(C)N(C(=O)CCCCCCCCCCCCCCCCC)C(C)(C)C2)CC(C)N(CC(=O)OC2CC(C)(C)N(C(=O)CCCCCCCCCCCCCCCCC)C(C)(C)C2)CC(=O)OC2CC(C)(C)N(C(=O)CCCCCCCCCCCCCCCCC)C(C)(C)C2)CC1(C)C
InChIInChI=1S/C151H282N8O15/c1-28-33-38-43-48-53-58-63-68-73-78-83-88-93-98-103-132(160)155-142(8,9)108-127(109-143(155,10)11)170-137(165)120-152(121-138(166)171-128-110-144(12,13)156(145(14,15)111-128)133(161)104-99-94-89-84-79-74-69-64-59-54-49-44-39-34-29-2)118-125(6)153(122-139(167)172-129-112-146(16,17)157(147(18,19)113-129)134(162)105-100-95-90-85-80-75-70-65-60-55-50-45-40-35-30-3)119-126(7)154(123-140(168)173-130-114-148(20,21)158(149(22,23)115-130)135(163)106-101-96-91-86-81-76-71-66-61-56-51-46-41-36-31-4)124-141(169)174-131-116-150(24,25)159(151(26,27)117-131)136(164)107-102-97-92-87-82-77-72-67-62-57-52-47-42-37-32-5/h125-131H,28-124H2,1-27H3
InChIKeyLQYYJTXDIJDQPF-UHFFFAOYSA-N
XLogP39.43
TPSA242.77 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds101
Heavy Atoms174
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002449.96
LogP ≤ 539.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Computed Properties (RDKit)

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

Analyze (2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl) 2-[2-[2-[bis[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]acetate with MolForge

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Frequently Asked Questions

What is the IUPAC name of (2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl) 2-[2-[2-[bis[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]acetate?
The IUPAC name of (2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl) 2-[2-[2-[bis[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]acetate (CID 54048127) is (2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl) 2-[2-[2-[bis[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]acetate.
What is the SMILES notation for (2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl) 2-[2-[2-[bis[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]acetate?
The canonical SMILES for (2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl) 2-[2-[2-[bis[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]acetate is CCCCCCCCCCCCCCCCCC(=O)N1C(C)(C)CC(OC(=O)CN(CC(=O)OC2CC(C)(C)N(C(=O)CCCCCCCCCCCCCCCCC)C(C)(C)C2)CC(C)N(CC(=O)OC2CC(C)(C)N(C(=O)CCCCCCCCCCCCCCCCC)C(C)(C)C2)CC(C)N(CC(=O)OC2CC(C)(C)N(C(=O)CCCCCCCCCCCCCCCCC)C(C)(C)C2)CC(=O)OC2CC(C)(C)N(C(=O)CCCCCCCCCCCCCCCCC)C(C)(C)C2)CC1(C)C.
What is the InChIKey of (2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl) 2-[2-[2-[bis[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]acetate?
The InChIKey is LQYYJTXDIJDQPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C151H282N8O15/c1-28-33-38-43-48-53-58-63-68-73-78-83-88-93-98-103-132(160)155-142(8,9)108-127(109-143(155,10)11)170-137(165)120-152(121-138(166)171-128-110-144(12,13)156(145(14,15)111-128)133(161)104-99-94-89-84-79-74-69-64-59-54-49-44-39-34-29-2)118-125(6)153(122-139(167)172-129-112-146(16,17)157(147(18,19)113-129)134(162)105-100-95-90-85-80-75-70-65-60-55-50-45-40-35-30-3)119-126(7)154(123-140(168)173-130-114-148(20,21)158(149(22,23)115-130)135(163)106-101-96-91-86-81-76-71-66-61-56-51-46-41-36-31-4)124-141(169)174-131-116-150(24,25)159(151(26,27)117-131)136(164)107-102-97-92-87-82-77-72-67-62-57-52-47-42-37-32-5/h125-131H,28-124H2,1-27H3.
What are the key properties of (2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl) 2-[2-[2-[bis[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]acetate?
(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl) 2-[2-[2-[bis[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]acetate has a molecular weight of 2449.96 g/mol, XLogP of 39.43, 101 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for (2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl) 2-[2-[2-[bis[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]propyl-[2-oxo-2-(2,2,6,6-tetramethyl-1-octadecanoylpiperidin-4-yl)oxyethyl]amino]acetate is sourced from PubChem (CID 54048127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).