N,N'-dibutyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexanediamide

C32H62N4O2 — CID 22323162

IUPACN,N'-dibutyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexanediamide
SMILESCCCCN(C(=O)CCCCC(=O)N(CCCC)C1CC(C)(C)NC(C)(C)C1)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C32H62N4O2/c1-11-13-19-35(25-21-29(3,4)33-30(5,6)22-25)27(37)17-15-16-18-28(38)36(20-14-12-2)26-23-31(7,8)34-32(9,10)24-26/h25-26,33-34H,11-24H2,1-10H3
InChIKeyDVYIFKCHSJSIDE-UHFFFAOYSA-N
MW534.87 g/mol
LogP6.42
Rot. Bonds13

About N,N'-dibutyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexanediamide

N,N'-dibutyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexanediamide (PubChem CID 22323162) has the molecular formula C32H62N4O2 and a molecular weight of 534.87 g/mol. Its IUPAC name is N,N'-dibutyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexanediamide.

Molecular Properties

Compound NameN,N'-dibutyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexanediamide
PubChem CID22323162
Molecular FormulaC32H62N4O2
Molecular Weight534.87 g/mol
Exact Mass534.49
IUPAC NameN,N'-dibutyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexanediamide
SMILESCCCCN(C(=O)CCCCC(=O)N(CCCC)C1CC(C)(C)NC(C)(C)C1)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C32H62N4O2/c1-11-13-19-35(25-21-29(3,4)33-30(5,6)22-25)27(37)17-15-16-18-28(38)36(20-14-12-2)26-23-31(7,8)34-32(9,10)24-26/h25-26,33-34H,11-24H2,1-10H3
InChIKeyDVYIFKCHSJSIDE-UHFFFAOYSA-N
XLogP6.42
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500534.87
LogP ≤ 56.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N'-dibutyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexanediamide?
The IUPAC name of N,N'-dibutyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexanediamide (CID 22323162) is N,N'-dibutyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexanediamide.
What is the SMILES notation for N,N'-dibutyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexanediamide?
The canonical SMILES for N,N'-dibutyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexanediamide is CCCCN(C(=O)CCCCC(=O)N(CCCC)C1CC(C)(C)NC(C)(C)C1)C1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of N,N'-dibutyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexanediamide?
The InChIKey is DVYIFKCHSJSIDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H62N4O2/c1-11-13-19-35(25-21-29(3,4)33-30(5,6)22-25)27(37)17-15-16-18-28(38)36(20-14-12-2)26-23-31(7,8)34-32(9,10)24-26/h25-26,33-34H,11-24H2,1-10H3.
What are the key properties of N,N'-dibutyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexanediamide?
N,N'-dibutyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexanediamide has a molecular weight of 534.87 g/mol, XLogP of 6.42, 13 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-dibutyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexanediamide is sourced from PubChem (CID 22323162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).