2,3-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2,3-dihydro-1-benzofuran-5-carboxamide

C20H30N2O2 — CID 166350427

IUPAC2,3-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2,3-dihydro-1-benzofuran-5-carboxamide
SMILESCC1Oc2ccc(C(=O)NC3CC(C)(C)NC(C)(C)C3)cc2C1C
InChIInChI=1S/C20H30N2O2/c1-12-13(2)24-17-8-7-14(9-16(12)17)18(23)21-15-10-19(3,4)22-20(5,6)11-15/h7-9,12-13,15,22H,10-11H2,1-6H3,(H,21,23)
InChIKeyZMLFTJOMKGXTIA-UHFFFAOYSA-N
MW330.47 g/mol
LogP3.61
Rot. Bonds2

About 2,3-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2,3-dihydro-1-benzofuran-5-carboxamide

2,3-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2,3-dihydro-1-benzofuran-5-carboxamide (PubChem CID 166350427) has the molecular formula C20H30N2O2 and a molecular weight of 330.47 g/mol. Its IUPAC name is 2,3-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2,3-dihydro-1-benzofuran-5-carboxamide.

Molecular Properties

Compound Name2,3-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2,3-dihydro-1-benzofuran-5-carboxamide
PubChem CID166350427
Molecular FormulaC20H30N2O2
Molecular Weight330.47 g/mol
Exact Mass330.23
IUPAC Name2,3-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2,3-dihydro-1-benzofuran-5-carboxamide
SMILESCC1Oc2ccc(C(=O)NC3CC(C)(C)NC(C)(C)C3)cc2C1C
InChIInChI=1S/C20H30N2O2/c1-12-13(2)24-17-8-7-14(9-16(12)17)18(23)21-15-10-19(3,4)22-20(5,6)11-15/h7-9,12-13,15,22H,10-11H2,1-6H3,(H,21,23)
InChIKeyZMLFTJOMKGXTIA-UHFFFAOYSA-N
XLogP3.61
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.47
LogP ≤ 53.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-N,3-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)benzene-1,3-dicarboxamide
CID 158461970
4-methylsulfonyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzamide
CID 17425450
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,3-dimethyl-2,3-dihydro-1-benzofuran-5-carboxamide
CID 167780671
4-anilino-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzamide
CID 67679426
2-methyl-1-methylsulfonyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2,3-dihydroindole-5-carboxamide
CID 17485264
5-bromo-6-oxo-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyran-3-carboxamide
CID 661226
4-[(3,4-dimethylphenyl)sulfamoyl]-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzamide
CID 17498159
5-hydroxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyridine-3-carboxamide
CID 63859431
1-N,3-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)naphthalene-1,3-dicarboxamide
CID 162717936
4-pyridin-4-yloxy-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzamide
CID 67679480
1-N-heptyl-4-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzene-1,4-dicarboxamide
CID 142858822
3-chloro-4-(2-methylphenoxy)-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzamide
CID 67678992

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2,3-dihydro-1-benzofuran-5-carboxamide?
The IUPAC name of 2,3-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2,3-dihydro-1-benzofuran-5-carboxamide (CID 166350427) is 2,3-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2,3-dihydro-1-benzofuran-5-carboxamide.
What is the SMILES notation for 2,3-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2,3-dihydro-1-benzofuran-5-carboxamide?
The canonical SMILES for 2,3-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2,3-dihydro-1-benzofuran-5-carboxamide is CC1Oc2ccc(C(=O)NC3CC(C)(C)NC(C)(C)C3)cc2C1C.
What is the InChIKey of 2,3-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2,3-dihydro-1-benzofuran-5-carboxamide?
The InChIKey is ZMLFTJOMKGXTIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N2O2/c1-12-13(2)24-17-8-7-14(9-16(12)17)18(23)21-15-10-19(3,4)22-20(5,6)11-15/h7-9,12-13,15,22H,10-11H2,1-6H3,(H,21,23).
What are the key properties of 2,3-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2,3-dihydro-1-benzofuran-5-carboxamide?
2,3-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2,3-dihydro-1-benzofuran-5-carboxamide has a molecular weight of 330.47 g/mol, XLogP of 3.61, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2,3-dihydro-1-benzofuran-5-carboxamide is sourced from PubChem (CID 166350427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).