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

C26H50N4O2 — CID 15883570

IUPACN,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)octanediamide
SMILESCC1(C)CC(NC(=O)CCCCCCC(=O)NC2CC(C)(C)NC(C)(C)C2)CC(C)(C)N1
InChIInChI=1S/C26H50N4O2/c1-23(2)15-19(16-24(3,4)29-23)27-21(31)13-11-9-10-12-14-22(32)28-20-17-25(5,6)30-26(7,8)18-20/h19-20,29-30H,9-18H2,1-8H3,(H,27,31)(H,28,32)
InChIKeyYBIBEAKXFYKCNA-UHFFFAOYSA-N
MW450.71 g/mol
LogP4.18
Rot. Bonds9

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

N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)octanediamide (PubChem CID 15883570) has the molecular formula C26H50N4O2 and a molecular weight of 450.71 g/mol. Its IUPAC name is N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)octanediamide.

Molecular Properties

Compound NameN,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)octanediamide
PubChem CID15883570
Molecular FormulaC26H50N4O2
Molecular Weight450.71 g/mol
Exact Mass450.39
IUPAC NameN,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)octanediamide
SMILESCC1(C)CC(NC(=O)CCCCCCC(=O)NC2CC(C)(C)NC(C)(C)C2)CC(C)(C)N1
InChIInChI=1S/C26H50N4O2/c1-23(2)15-19(16-24(3,4)29-23)27-21(31)13-11-9-10-12-14-22(32)28-20-17-25(5,6)30-26(7,8)18-20/h19-20,29-30H,9-18H2,1-8H3,(H,27,31)(H,28,32)
InChIKeyYBIBEAKXFYKCNA-UHFFFAOYSA-N
XLogP4.18
TPSA82.26 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500450.71
LogP ≤ 54.18
H-Bond Donors ≤ 54
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'-bis(2,2,6,6-tetramethylpiperidin-4-yl)octanediamide?
The IUPAC name of N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)octanediamide (CID 15883570) is N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)octanediamide.
What is the SMILES notation for N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)octanediamide?
The canonical SMILES for N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)octanediamide is CC1(C)CC(NC(=O)CCCCCCC(=O)NC2CC(C)(C)NC(C)(C)C2)CC(C)(C)N1.
What is the InChIKey of N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)octanediamide?
The InChIKey is YBIBEAKXFYKCNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H50N4O2/c1-23(2)15-19(16-24(3,4)29-23)27-21(31)13-11-9-10-12-14-22(32)28-20-17-25(5,6)30-26(7,8)18-20/h19-20,29-30H,9-18H2,1-8H3,(H,27,31)(H,28,32).
What are the key properties of N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)octanediamide?
N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)octanediamide has a molecular weight of 450.71 g/mol, XLogP of 4.18, 9 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)octanediamide is sourced from PubChem (CID 15883570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).