N-[1-(4-acetamido-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-2,2,6,6-tetramethylpiperidin-4-yl]acetamide

C22H42N4O4 — CID 91804541

IUPACN-[1-(4-acetamido-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-2,2,6,6-tetramethylpiperidin-4-yl]acetamide
SMILESCC(=O)NC1CC(C)(C)N(OC2(NC(C)=O)CC(C)(C)N(O)C(C)(C)C2)C(C)(C)C1
InChIInChI=1S/C22H42N4O4/c1-15(27)23-17-11-18(3,4)26(19(5,6)12-17)30-22(24-16(2)28)13-20(7,8)25(29)21(9,10)14-22/h17,29H,11-14H2,1-10H3,(H,23,27)(H,24,28)
InChIKeyIULSSDNJHZVMLQ-UHFFFAOYSA-N
MW426.60 g/mol
LogP2.95
Rot. Bonds4

About N-[1-(4-acetamido-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-2,2,6,6-tetramethylpiperidin-4-yl]acetamide

N-[1-(4-acetamido-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-2,2,6,6-tetramethylpiperidin-4-yl]acetamide (PubChem CID 91804541) has the molecular formula C22H42N4O4 and a molecular weight of 426.60 g/mol. Its IUPAC name is N-[1-(4-acetamido-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-2,2,6,6-tetramethylpiperidin-4-yl]acetamide.

Molecular Properties

Compound NameN-[1-(4-acetamido-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-2,2,6,6-tetramethylpiperidin-4-yl]acetamide
PubChem CID91804541
Molecular FormulaC22H42N4O4
Molecular Weight426.60 g/mol
Exact Mass426.32
IUPAC NameN-[1-(4-acetamido-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-2,2,6,6-tetramethylpiperidin-4-yl]acetamide
SMILESCC(=O)NC1CC(C)(C)N(OC2(NC(C)=O)CC(C)(C)N(O)C(C)(C)C2)C(C)(C)C1
InChIInChI=1S/C22H42N4O4/c1-15(27)23-17-11-18(3,4)26(19(5,6)12-17)30-22(24-16(2)28)13-20(7,8)25(29)21(9,10)14-22/h17,29H,11-14H2,1-10H3,(H,23,27)(H,24,28)
InChIKeyIULSSDNJHZVMLQ-UHFFFAOYSA-N
XLogP2.95
TPSA94.14 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.60
LogP ≤ 52.95
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[1-(4-acetamido-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-2,2,6,6-tetramethylpiperidin-4-yl]acetamide?
The IUPAC name of N-[1-(4-acetamido-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-2,2,6,6-tetramethylpiperidin-4-yl]acetamide (CID 91804541) is N-[1-(4-acetamido-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-2,2,6,6-tetramethylpiperidin-4-yl]acetamide.
What is the SMILES notation for N-[1-(4-acetamido-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-2,2,6,6-tetramethylpiperidin-4-yl]acetamide?
The canonical SMILES for N-[1-(4-acetamido-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-2,2,6,6-tetramethylpiperidin-4-yl]acetamide is CC(=O)NC1CC(C)(C)N(OC2(NC(C)=O)CC(C)(C)N(O)C(C)(C)C2)C(C)(C)C1.
What is the InChIKey of N-[1-(4-acetamido-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-2,2,6,6-tetramethylpiperidin-4-yl]acetamide?
The InChIKey is IULSSDNJHZVMLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H42N4O4/c1-15(27)23-17-11-18(3,4)26(19(5,6)12-17)30-22(24-16(2)28)13-20(7,8)25(29)21(9,10)14-22/h17,29H,11-14H2,1-10H3,(H,23,27)(H,24,28).
What are the key properties of N-[1-(4-acetamido-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-2,2,6,6-tetramethylpiperidin-4-yl]acetamide?
N-[1-(4-acetamido-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-2,2,6,6-tetramethylpiperidin-4-yl]acetamide has a molecular weight of 426.60 g/mol, XLogP of 2.95, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-acetamido-1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-2,2,6,6-tetramethylpiperidin-4-yl]acetamide is sourced from PubChem (CID 91804541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).