2-(5-methyl-1-benzofuran-3-yl)-N-(4-phenoxyphenyl)acetamide

C23H19NO3 — CID 18872348

IUPAC2-(5-methyl-1-benzofuran-3-yl)-N-(4-phenoxyphenyl)acetamide
SMILESCc1ccc2occ(CC(=O)Nc3ccc(Oc4ccccc4)cc3)c2c1
InChIInChI=1S/C23H19NO3/c1-16-7-12-22-21(13-16)17(15-26-22)14-23(25)24-18-8-10-20(11-9-18)27-19-5-3-2-4-6-19/h2-13,15H,14H2,1H3,(H,24,25)
InChIKeyRRYRHWUEAFUXPH-UHFFFAOYSA-N
MW357.41 g/mol
LogP5.71
Rot. Bonds5

About 2-(5-methyl-1-benzofuran-3-yl)-N-(4-phenoxyphenyl)acetamide

2-(5-methyl-1-benzofuran-3-yl)-N-(4-phenoxyphenyl)acetamide (PubChem CID 18872348) has the molecular formula C23H19NO3 and a molecular weight of 357.41 g/mol. Its IUPAC name is 2-(5-methyl-1-benzofuran-3-yl)-N-(4-phenoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(5-methyl-1-benzofuran-3-yl)-N-(4-phenoxyphenyl)acetamide
PubChem CID18872348
Molecular FormulaC23H19NO3
Molecular Weight357.41 g/mol
Exact Mass357.14
IUPAC Name2-(5-methyl-1-benzofuran-3-yl)-N-(4-phenoxyphenyl)acetamide
SMILESCc1ccc2occ(CC(=O)Nc3ccc(Oc4ccccc4)cc3)c2c1
InChIInChI=1S/C23H19NO3/c1-16-7-12-22-21(13-16)17(15-26-22)14-23(25)24-18-8-10-20(11-9-18)27-19-5-3-2-4-6-19/h2-13,15H,14H2,1H3,(H,24,25)
InChIKeyRRYRHWUEAFUXPH-UHFFFAOYSA-N
XLogP5.71
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500357.41
LogP ≤ 55.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5-methyl-1-benzofuran-3-yl)-N-phenylacetamide
CID 18860446
2-(5-methyl-1-benzofuran-3-yl)-N'-(2-phenoxyacetyl)acetohydrazide
CID 18872422
2-(5-methyl-1-benzofuran-3-yl)-N-pyridin-3-ylacetamide
CID 2973081
N'-[2-(5-methyl-1-benzofuran-3-yl)acetyl]-2-phenylacetohydrazide
CID 18872421
N-(3-acetylphenyl)-2-(5-methyl-1-benzofuran-3-yl)acetamide
CID 18872372
2-(5-methoxy-1-benzofuran-3-yl)-N-naphthalen-2-ylacetamide
CID 18860246
3-[[2-(5-methyl-1-benzofuran-3-yl)acetyl]amino]-N-phenyl-1-benzofuran-2-carboxamide
CID 18861171
2-(5-methyl-1-benzofuran-3-yl)-N-propan-2-ylacetamide
CID 18872376
2-(5-methyl-1-benzofuran-3-yl)-N-(2-phenylethyl)acetamide
CID 18872386
2-(6-methyl-1-benzofuran-3-yl)-N-[4-(2,2,2-trifluoroethoxy)phenyl]acetamide
CID 134010405
(4-methylphenyl) 2-(5-methyl-1-benzofuran-3-yl)acetate
CID 18872439
2-(1-benzofuran-3-yl)-N-(3,4-dimethylphenyl)acetamide
CID 110485842

Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-1-benzofuran-3-yl)-N-(4-phenoxyphenyl)acetamide?
The IUPAC name of 2-(5-methyl-1-benzofuran-3-yl)-N-(4-phenoxyphenyl)acetamide (CID 18872348) is 2-(5-methyl-1-benzofuran-3-yl)-N-(4-phenoxyphenyl)acetamide.
What is the SMILES notation for 2-(5-methyl-1-benzofuran-3-yl)-N-(4-phenoxyphenyl)acetamide?
The canonical SMILES for 2-(5-methyl-1-benzofuran-3-yl)-N-(4-phenoxyphenyl)acetamide is Cc1ccc2occ(CC(=O)Nc3ccc(Oc4ccccc4)cc3)c2c1.
What is the InChIKey of 2-(5-methyl-1-benzofuran-3-yl)-N-(4-phenoxyphenyl)acetamide?
The InChIKey is RRYRHWUEAFUXPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19NO3/c1-16-7-12-22-21(13-16)17(15-26-22)14-23(25)24-18-8-10-20(11-9-18)27-19-5-3-2-4-6-19/h2-13,15H,14H2,1H3,(H,24,25).
What are the key properties of 2-(5-methyl-1-benzofuran-3-yl)-N-(4-phenoxyphenyl)acetamide?
2-(5-methyl-1-benzofuran-3-yl)-N-(4-phenoxyphenyl)acetamide has a molecular weight of 357.41 g/mol, XLogP of 5.71, 5 rotatable bonds, 1 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-(4-phenoxyphenyl)acetamide is sourced from PubChem (CID 18872348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).