2-(5-methyl-1-benzofuran-3-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide

C20H28N2O2 — CID 18872448

IUPAC2-(5-methyl-1-benzofuran-3-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide
SMILESCc1ccc2occ(CC(=O)NC3CC(C)(C)NC(C)(C)C3)c2c1
InChIInChI=1S/C20H28N2O2/c1-13-6-7-17-16(8-13)14(12-24-17)9-18(23)21-15-10-19(2,3)22-20(4,5)11-15/h6-8,12,15,22H,9-11H2,1-5H3,(H,21,23)
InChIKeyZTXRHYWERNUJRD-UHFFFAOYSA-N
MW328.46 g/mol
LogP3.71
Rot. Bonds3

About 2-(5-methyl-1-benzofuran-3-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide

2-(5-methyl-1-benzofuran-3-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide (PubChem CID 18872448) has the molecular formula C20H28N2O2 and a molecular weight of 328.46 g/mol. Its IUPAC name is 2-(5-methyl-1-benzofuran-3-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide.

Molecular Properties

Compound Name2-(5-methyl-1-benzofuran-3-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide
PubChem CID18872448
Molecular FormulaC20H28N2O2
Molecular Weight328.46 g/mol
Exact Mass328.22
IUPAC Name2-(5-methyl-1-benzofuran-3-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide
SMILESCc1ccc2occ(CC(=O)NC3CC(C)(C)NC(C)(C)C3)c2c1
InChIInChI=1S/C20H28N2O2/c1-13-6-7-17-16(8-13)14(12-24-17)9-18(23)21-15-10-19(2,3)22-20(4,5)11-15/h6-8,12,15,22H,9-11H2,1-5H3,(H,21,23)
InChIKeyZTXRHYWERNUJRD-UHFFFAOYSA-N
XLogP3.71
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.46
LogP ≤ 53.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-1-benzofuran-3-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide?
The IUPAC name of 2-(5-methyl-1-benzofuran-3-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide (CID 18872448) is 2-(5-methyl-1-benzofuran-3-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide.
What is the SMILES notation for 2-(5-methyl-1-benzofuran-3-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide?
The canonical SMILES for 2-(5-methyl-1-benzofuran-3-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide is Cc1ccc2occ(CC(=O)NC3CC(C)(C)NC(C)(C)C3)c2c1.
What is the InChIKey of 2-(5-methyl-1-benzofuran-3-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide?
The InChIKey is ZTXRHYWERNUJRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N2O2/c1-13-6-7-17-16(8-13)14(12-24-17)9-18(23)21-15-10-19(2,3)22-20(4,5)11-15/h6-8,12,15,22H,9-11H2,1-5H3,(H,21,23).
What are the key properties of 2-(5-methyl-1-benzofuran-3-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide?
2-(5-methyl-1-benzofuran-3-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide has a molecular weight of 328.46 g/mol, XLogP of 3.71, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-1-benzofuran-3-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide is sourced from PubChem (CID 18872448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).