3-acetamido-N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide

C18H16N2O4 — CID 20875163

IUPAC3-acetamido-N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide
SMILESCOc1ccc(NC(=O)c2oc3ccccc3c2NC(C)=O)cc1
InChIInChI=1S/C18H16N2O4/c1-11(21)19-16-14-5-3-4-6-15(14)24-17(16)18(22)20-12-7-9-13(23-2)10-8-12/h3-10H,1-2H3,(H,19,21)(H,20,22)
InChIKeyFAJKNDNDYAIFOZ-UHFFFAOYSA-N
MW324.34 g/mol
LogP3.65
Rot. Bonds4

About 3-acetamido-N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide

3-acetamido-N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide (PubChem CID 20875163) has the molecular formula C18H16N2O4 and a molecular weight of 324.34 g/mol. Its IUPAC name is 3-acetamido-N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide.

Molecular Properties

Compound Name3-acetamido-N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide
PubChem CID20875163
Molecular FormulaC18H16N2O4
Molecular Weight324.34 g/mol
Exact Mass324.11
IUPAC Name3-acetamido-N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide
SMILESCOc1ccc(NC(=O)c2oc3ccccc3c2NC(C)=O)cc1
InChIInChI=1S/C18H16N2O4/c1-11(21)19-16-14-5-3-4-6-15(14)24-17(16)18(22)20-12-7-9-13(23-2)10-8-12/h3-10H,1-2H3,(H,19,21)(H,20,22)
InChIKeyFAJKNDNDYAIFOZ-UHFFFAOYSA-N
XLogP3.65
TPSA80.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.34
LogP ≤ 53.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-methoxyphenyl)-3-(propanoylamino)-1-benzofuran-2-carboxamide
CID 7116970
3-(2,2-dimethylpropanoylamino)-N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide
CID 3241060
N-(4-methoxyphenyl)-3-[(2-methylbenzoyl)amino]-1-benzofuran-2-carboxamide
CID 20875169
3-[(4-bromobenzoyl)amino]-N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide
CID 16814422
N-(4-methoxyphenyl)-3-[[(2S)-2-phenoxypropanoyl]amino]-1-benzofuran-2-carboxamide
CID 41294972
N-(4-methoxyphenyl)-3-(3-phenylprop-2-enoylamino)-1-benzofuran-2-carboxamide
CID 7159740
N-(4-methoxyphenyl)-3-[[2-(4-methylphenoxy)acetyl]amino]-1-benzofuran-2-carboxamide
CID 16814466
3-acetamido-N-(4-ethylphenyl)-1-benzofuran-2-carboxamide
CID 7501768
(3R)-N-[2-[(4-methoxyphenyl)carbamoyl]-1-benzofuran-3-yl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide
CID 35043971
3-benzamido-N-(4-ethoxyphenyl)-1-benzofuran-2-carboxamide
CID 20875337
3-[[(2R)-2-phenoxypropanoyl]amino]-N-phenyl-1-benzofuran-2-carboxamide
CID 7159658
N-(4-ethoxyphenyl)-3-[[2-(4-ethoxyphenyl)acetyl]amino]-1-benzofuran-2-carboxamide
CID 20875357

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide?
The IUPAC name of 3-acetamido-N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide (CID 20875163) is 3-acetamido-N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide.
What is the SMILES notation for 3-acetamido-N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide?
The canonical SMILES for 3-acetamido-N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide is COc1ccc(NC(=O)c2oc3ccccc3c2NC(C)=O)cc1.
What is the InChIKey of 3-acetamido-N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide?
The InChIKey is FAJKNDNDYAIFOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O4/c1-11(21)19-16-14-5-3-4-6-15(14)24-17(16)18(22)20-12-7-9-13(23-2)10-8-12/h3-10H,1-2H3,(H,19,21)(H,20,22).
What are the key properties of 3-acetamido-N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide?
3-acetamido-N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide has a molecular weight of 324.34 g/mol, XLogP of 3.65, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-N-(4-methoxyphenyl)-1-benzofuran-2-carboxamide is sourced from PubChem (CID 20875163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).