2-(5,6-dimethyl-1-benzofuran-3-yl)-N-(2-phenylphenyl)acetamide

C24H21NO2 — CID 16546100

IUPAC2-(5,6-dimethyl-1-benzofuran-3-yl)-N-(2-phenylphenyl)acetamide
SMILESCc1cc2occ(CC(=O)Nc3ccccc3-c3ccccc3)c2cc1C
InChIInChI=1S/C24H21NO2/c1-16-12-21-19(15-27-23(21)13-17(16)2)14-24(26)25-22-11-7-6-10-20(22)18-8-4-3-5-9-18/h3-13,15H,14H2,1-2H3,(H,25,26)
InChIKeyGNHDQYODCUPTCI-UHFFFAOYSA-N
MW355.44 g/mol
LogP5.90
Rot. Bonds4

About 2-(5,6-dimethyl-1-benzofuran-3-yl)-N-(2-phenylphenyl)acetamide

2-(5,6-dimethyl-1-benzofuran-3-yl)-N-(2-phenylphenyl)acetamide (PubChem CID 16546100) has the molecular formula C24H21NO2 and a molecular weight of 355.44 g/mol. Its IUPAC name is 2-(5,6-dimethyl-1-benzofuran-3-yl)-N-(2-phenylphenyl)acetamide.

Molecular Properties

Compound Name2-(5,6-dimethyl-1-benzofuran-3-yl)-N-(2-phenylphenyl)acetamide
PubChem CID16546100
Molecular FormulaC24H21NO2
Molecular Weight355.44 g/mol
Exact Mass355.16
IUPAC Name2-(5,6-dimethyl-1-benzofuran-3-yl)-N-(2-phenylphenyl)acetamide
SMILESCc1cc2occ(CC(=O)Nc3ccccc3-c3ccccc3)c2cc1C
InChIInChI=1S/C24H21NO2/c1-16-12-21-19(15-27-23(21)13-17(16)2)14-24(26)25-22-11-7-6-10-20(22)18-8-4-3-5-9-18/h3-13,15H,14H2,1-2H3,(H,25,26)
InChIKeyGNHDQYODCUPTCI-UHFFFAOYSA-N
XLogP5.90
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500355.44
LogP ≤ 55.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(5,6-dimethyl-1-benzofuran-3-yl)-N-(2-methylphenyl)acetamide
CID 7946686
2-(5,6-dimethyl-1-benzofuran-3-yl)-N-(2-methoxyphenyl)acetamide
CID 17404145
2-(5,6-dimethyl-1-benzofuran-3-yl)-N-(4-fluoro-2-methylphenyl)acetamide
CID 8864750
2-(5,6-dimethyl-1-benzofuran-3-yl)-N-(3,4-dimethylphenyl)acetamide
CID 16547774
N-benzhydryl-2-(5,6-dimethyl-1-benzofuran-3-yl)acetamide
CID 7930956
N-(4-acetamido-3-methylphenyl)-2-(5,6-dimethyl-1-benzofuran-3-yl)acetamide
CID 46550765
N-(3-acetylphenyl)-2-(5,6-dimethyl-1-benzofuran-3-yl)acetamide
CID 7770634
N-(2-chloro-4-fluorophenyl)-2-(5,6-dimethyl-1-benzofuran-3-yl)acetamide
CID 26364046
2-(5,6-dimethyl-1-benzofuran-3-yl)-N-(4-fluorophenyl)acetamide
CID 7733151
2-(3-methoxy-4-methylphenyl)-N-(2-phenylphenyl)acetamide
CID 17476881
N-(2-benzylpyrazol-3-yl)-2-(5,6-dimethyl-1-benzofuran-3-yl)acetamide
CID 17395817
N-(2-methoxyphenyl)-2-(6-methyl-1-benzofuran-3-yl)acetamide
CID 2599354

Frequently Asked Questions

What is the IUPAC name of 2-(5,6-dimethyl-1-benzofuran-3-yl)-N-(2-phenylphenyl)acetamide?
The IUPAC name of 2-(5,6-dimethyl-1-benzofuran-3-yl)-N-(2-phenylphenyl)acetamide (CID 16546100) is 2-(5,6-dimethyl-1-benzofuran-3-yl)-N-(2-phenylphenyl)acetamide.
What is the SMILES notation for 2-(5,6-dimethyl-1-benzofuran-3-yl)-N-(2-phenylphenyl)acetamide?
The canonical SMILES for 2-(5,6-dimethyl-1-benzofuran-3-yl)-N-(2-phenylphenyl)acetamide is Cc1cc2occ(CC(=O)Nc3ccccc3-c3ccccc3)c2cc1C.
What is the InChIKey of 2-(5,6-dimethyl-1-benzofuran-3-yl)-N-(2-phenylphenyl)acetamide?
The InChIKey is GNHDQYODCUPTCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21NO2/c1-16-12-21-19(15-27-23(21)13-17(16)2)14-24(26)25-22-11-7-6-10-20(22)18-8-4-3-5-9-18/h3-13,15H,14H2,1-2H3,(H,25,26).
What are the key properties of 2-(5,6-dimethyl-1-benzofuran-3-yl)-N-(2-phenylphenyl)acetamide?
2-(5,6-dimethyl-1-benzofuran-3-yl)-N-(2-phenylphenyl)acetamide has a molecular weight of 355.44 g/mol, XLogP of 5.90, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,6-dimethyl-1-benzofuran-3-yl)-N-(2-phenylphenyl)acetamide is sourced from PubChem (CID 16546100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).