2,2,6,6-tetramethyl-4-[1,1,1,2,2-pentakis(2,2,6,6-tetramethylpiperidin-4-yl)dodecan-3-yl]piperidine

C66H128N6 — CID 57198690

IUPAC2,2,6,6-tetramethyl-4-[1,1,1,2,2-pentakis(2,2,6,6-tetramethylpiperidin-4-yl)dodecan-3-yl]piperidine
SMILESCCCCCCCCCC(C1CC(C)(C)NC(C)(C)C1)C(C1CC(C)(C)NC(C)(C)C1)(C1CC(C)(C)NC(C)(C)C1)C(C1CC(C)(C)NC(C)(C)C1)(C1CC(C)(C)NC(C)(C)C1)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C66H128N6/c1-26-27-28-29-30-31-32-33-52(46-34-53(2,3)67-54(4,5)35-46)66(50-42-61(18,19)71-62(20,21)43-50,51-44-63(22,23)72-64(24,25)45-51)65(47-36-55(6,7)68-56(8,9)37-47,48-38-57(10,11)69-58(12,13)39-48)49-40-59(14,15)70-60(16,17)41-49/h46-52,67-72H,26-45H2,1-25H3
InChIKeySNAGVNKPEQKONI-UHFFFAOYSA-N
MW1005.79 g/mol
LogP16.06
Rot. Bonds16

About 2,2,6,6-tetramethyl-4-[1,1,1,2,2-pentakis(2,2,6,6-tetramethylpiperidin-4-yl)dodecan-3-yl]piperidine

2,2,6,6-tetramethyl-4-[1,1,1,2,2-pentakis(2,2,6,6-tetramethylpiperidin-4-yl)dodecan-3-yl]piperidine (PubChem CID 57198690) has the molecular formula C66H128N6 and a molecular weight of 1005.79 g/mol. Its IUPAC name is 2,2,6,6-tetramethyl-4-[1,1,1,2,2-pentakis(2,2,6,6-tetramethylpiperidin-4-yl)dodecan-3-yl]piperidine.

Molecular Properties

Compound Name2,2,6,6-tetramethyl-4-[1,1,1,2,2-pentakis(2,2,6,6-tetramethylpiperidin-4-yl)dodecan-3-yl]piperidine
PubChem CID57198690
Molecular FormulaC66H128N6
Molecular Weight1005.79 g/mol
Exact Mass1005.02
IUPAC Name2,2,6,6-tetramethyl-4-[1,1,1,2,2-pentakis(2,2,6,6-tetramethylpiperidin-4-yl)dodecan-3-yl]piperidine
SMILESCCCCCCCCCC(C1CC(C)(C)NC(C)(C)C1)C(C1CC(C)(C)NC(C)(C)C1)(C1CC(C)(C)NC(C)(C)C1)C(C1CC(C)(C)NC(C)(C)C1)(C1CC(C)(C)NC(C)(C)C1)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C66H128N6/c1-26-27-28-29-30-31-32-33-52(46-34-53(2,3)67-54(4,5)35-46)66(50-42-61(18,19)71-62(20,21)43-50,51-44-63(22,23)72-64(24,25)45-51)65(47-36-55(6,7)68-56(8,9)37-47,48-38-57(10,11)69-58(12,13)39-48)49-40-59(14,15)70-60(16,17)41-49/h46-52,67-72H,26-45H2,1-25H3
InChIKeySNAGVNKPEQKONI-UHFFFAOYSA-N
XLogP16.06
TPSA72.18 Ų
H-Bond Donors6
H-Bond Acceptors6
Rotatable Bonds16
Heavy Atoms72
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001005.79
LogP ≤ 516.06
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2,2,6,6-Tetramethyl-4-[1,1,1-tris(2,2,6,6-tetramethylpiperidin-4-yl)butan-2-yl]piperidine
CID 18691677
4-[1,1-Bis(2,2,6,6-tetramethylpiperidin-4-yl)butyl]-2,2,6,6-tetramethylpiperidine
CID 20493998
[3-(Aminomethyl)-1,2,2,3-tetrakis(2,2,6,6-tetramethylpiperidin-4-yl)cyclohexyl]methanamine
CID 20494014
4-[2-[1,1-Bis(2,2,6,6-tetramethylpiperidin-4-yl)ethyl]-3-methyl-3-(2,2,6,6-tetramethylpiperidin-4-yl)pentan-2-yl]-2,2,6,6-tetramethylpiperidine
CID 21666455
2,2,6,6-Tetramethyl-4-[1,3,4-tris(2,2,6,6-tetramethylpiperidin-4-yl)butan-2-yl]piperidine
CID 23225747
4-[3,3-Dimethyl-1,1-bis(2,2,6,6-tetramethylpiperidin-4-yl)butyl]-2,2,6,6-tetramethylpiperidine
CID 58038487
2,2,3,4-Tetrakis(1-ethylpiperidin-4-yl)-3-[1-(2-methylpropyl)piperidin-4-yl]-5-piperidin-4-yl-5-(2-piperidin-1-ylethyl)-1-propan-2-ylpiperidine
CID 91801630
2,2,6,6-Tetramethyl-4-[2,3,3-tris(2,2,6,6-tetramethylpiperidin-4-yl)butan-2-yl]piperidine
CID 131731190
1,2,2,6,6-Pentamethyl-4-[4-(1,2,2,6,6-pentamethylpiperidin-4-yl)-2,3,5-tris(2,2,6,6-tetramethylpiperidin-4-yl)cyclohexyl]piperidine
CID 139317273
2,2,6,6-Tetramethyl-4-[2,3,4-tris(2,2,6,6-tetramethylpiperidin-4-yl)cyclohexyl]piperidine
CID 139317413
2,2,6,6-Tetramethyl-4-[2,3,4-tris(2,2,6,6-tetramethylpiperidin-4-yl)cyclopentyl]piperidine
CID 139317604
2,2,6,6-Tetramethyl-4-[2,3,4,5-tetrakis(2,2,6,6-tetramethylpiperidin-4-yl)cyclohexyl]piperidine
CID 139317615

Frequently Asked Questions

What is the IUPAC name of 2,2,6,6-tetramethyl-4-[1,1,1,2,2-pentakis(2,2,6,6-tetramethylpiperidin-4-yl)dodecan-3-yl]piperidine?
The IUPAC name of 2,2,6,6-tetramethyl-4-[1,1,1,2,2-pentakis(2,2,6,6-tetramethylpiperidin-4-yl)dodecan-3-yl]piperidine (CID 57198690) is 2,2,6,6-tetramethyl-4-[1,1,1,2,2-pentakis(2,2,6,6-tetramethylpiperidin-4-yl)dodecan-3-yl]piperidine.
What is the SMILES notation for 2,2,6,6-tetramethyl-4-[1,1,1,2,2-pentakis(2,2,6,6-tetramethylpiperidin-4-yl)dodecan-3-yl]piperidine?
The canonical SMILES for 2,2,6,6-tetramethyl-4-[1,1,1,2,2-pentakis(2,2,6,6-tetramethylpiperidin-4-yl)dodecan-3-yl]piperidine is CCCCCCCCCC(C1CC(C)(C)NC(C)(C)C1)C(C1CC(C)(C)NC(C)(C)C1)(C1CC(C)(C)NC(C)(C)C1)C(C1CC(C)(C)NC(C)(C)C1)(C1CC(C)(C)NC(C)(C)C1)C1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of 2,2,6,6-tetramethyl-4-[1,1,1,2,2-pentakis(2,2,6,6-tetramethylpiperidin-4-yl)dodecan-3-yl]piperidine?
The InChIKey is SNAGVNKPEQKONI-UHFFFAOYSA-N. The full InChI is InChI=1S/C66H128N6/c1-26-27-28-29-30-31-32-33-52(46-34-53(2,3)67-54(4,5)35-46)66(50-42-61(18,19)71-62(20,21)43-50,51-44-63(22,23)72-64(24,25)45-51)65(47-36-55(6,7)68-56(8,9)37-47,48-38-57(10,11)69-58(12,13)39-48)49-40-59(14,15)70-60(16,17)41-49/h46-52,67-72H,26-45H2,1-25H3.
What are the key properties of 2,2,6,6-tetramethyl-4-[1,1,1,2,2-pentakis(2,2,6,6-tetramethylpiperidin-4-yl)dodecan-3-yl]piperidine?
2,2,6,6-tetramethyl-4-[1,1,1,2,2-pentakis(2,2,6,6-tetramethylpiperidin-4-yl)dodecan-3-yl]piperidine has a molecular weight of 1005.79 g/mol, XLogP of 16.06, 16 rotatable bonds, 6 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,6,6-tetramethyl-4-[1,1,1,2,2-pentakis(2,2,6,6-tetramethylpiperidin-4-yl)dodecan-3-yl]piperidine is sourced from PubChem (CID 57198690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).