N-[3-(2-amino-2-oxoethoxy)phenyl]-2-(6-ethyl-1-benzofuran-3-yl)acetamide

C20H20N2O4 — CID 18167476

IUPACN-[3-(2-amino-2-oxoethoxy)phenyl]-2-(6-ethyl-1-benzofuran-3-yl)acetamide
SMILESCCc1ccc2c(CC(=O)Nc3cccc(OCC(N)=O)c3)coc2c1
InChIInChI=1S/C20H20N2O4/c1-2-13-6-7-17-14(11-26-18(17)8-13)9-20(24)22-15-4-3-5-16(10-15)25-12-19(21)23/h3-8,10-11H,2,9,12H2,1H3,(H2,21,23)(H,22,24)
InChIKeyXFEPFUUOXYCEIJ-UHFFFAOYSA-N
MW352.39 g/mol
LogP3.04
Rot. Bonds7

About N-[3-(2-amino-2-oxoethoxy)phenyl]-2-(6-ethyl-1-benzofuran-3-yl)acetamide

N-[3-(2-amino-2-oxoethoxy)phenyl]-2-(6-ethyl-1-benzofuran-3-yl)acetamide (PubChem CID 18167476) has the molecular formula C20H20N2O4 and a molecular weight of 352.39 g/mol. Its IUPAC name is N-[3-(2-amino-2-oxoethoxy)phenyl]-2-(6-ethyl-1-benzofuran-3-yl)acetamide.

Molecular Properties

Compound NameN-[3-(2-amino-2-oxoethoxy)phenyl]-2-(6-ethyl-1-benzofuran-3-yl)acetamide
PubChem CID18167476
Molecular FormulaC20H20N2O4
Molecular Weight352.39 g/mol
Exact Mass352.14
IUPAC NameN-[3-(2-amino-2-oxoethoxy)phenyl]-2-(6-ethyl-1-benzofuran-3-yl)acetamide
SMILESCCc1ccc2c(CC(=O)Nc3cccc(OCC(N)=O)c3)coc2c1
InChIInChI=1S/C20H20N2O4/c1-2-13-6-7-17-14(11-26-18(17)8-13)9-20(24)22-15-4-3-5-16(10-15)25-12-19(21)23/h3-8,10-11H,2,9,12H2,1H3,(H2,21,23)(H,22,24)
InChIKeyXFEPFUUOXYCEIJ-UHFFFAOYSA-N
XLogP3.04
TPSA94.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.39
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(2-amino-2-oxoethoxy)phenyl]-2-(4-ethoxyphenyl)acetamide
CID 24649938
N'-[2-(3,5-dimethylphenoxy)acetyl]-2-(6-ethyl-1-benzofuran-3-yl)acetohydrazide
CID 9470559
[2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl] 2-(6-ethyl-1-benzofuran-3-yl)acetate
CID 8846121
N-[3-(2-amino-2-oxoethoxy)phenyl]-3-oxobutanamide
CID 61251264
2-(6-ethyl-1-benzofuran-3-yl)-N-propan-2-ylacetamide
CID 18107939
N-[3-(2-amino-2-oxoethoxy)phenyl]-2-(3-fluoro-4-methoxyphenyl)acetamide
CID 24649985
3-[[2-(6-methoxy-1-benzofuran-3-yl)acetyl]amino]benzamide
CID 17394423
N-[3-(2-amino-2-oxoethoxy)phenyl]-2-(2-methoxyphenyl)acetamide
CID 18155390
N-[3-(2-amino-2-oxoethoxy)phenyl]-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
CID 18155389
2-[4-[[2-(6-methyl-1-benzofuran-3-yl)acetyl]amino]phenyl]acetamide
CID 31856404
[2-oxo-2-[4-(propanoylamino)phenyl]ethyl] 2-(6-ethyl-1-benzofuran-3-yl)acetate
CID 8525426
2-(5-ethyl-1-benzofuran-3-yl)-N-naphthalen-2-ylacetamide
CID 18860488

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-amino-2-oxoethoxy)phenyl]-2-(6-ethyl-1-benzofuran-3-yl)acetamide?
The IUPAC name of N-[3-(2-amino-2-oxoethoxy)phenyl]-2-(6-ethyl-1-benzofuran-3-yl)acetamide (CID 18167476) is N-[3-(2-amino-2-oxoethoxy)phenyl]-2-(6-ethyl-1-benzofuran-3-yl)acetamide.
What is the SMILES notation for N-[3-(2-amino-2-oxoethoxy)phenyl]-2-(6-ethyl-1-benzofuran-3-yl)acetamide?
The canonical SMILES for N-[3-(2-amino-2-oxoethoxy)phenyl]-2-(6-ethyl-1-benzofuran-3-yl)acetamide is CCc1ccc2c(CC(=O)Nc3cccc(OCC(N)=O)c3)coc2c1.
What is the InChIKey of N-[3-(2-amino-2-oxoethoxy)phenyl]-2-(6-ethyl-1-benzofuran-3-yl)acetamide?
The InChIKey is XFEPFUUOXYCEIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O4/c1-2-13-6-7-17-14(11-26-18(17)8-13)9-20(24)22-15-4-3-5-16(10-15)25-12-19(21)23/h3-8,10-11H,2,9,12H2,1H3,(H2,21,23)(H,22,24).
What are the key properties of N-[3-(2-amino-2-oxoethoxy)phenyl]-2-(6-ethyl-1-benzofuran-3-yl)acetamide?
N-[3-(2-amino-2-oxoethoxy)phenyl]-2-(6-ethyl-1-benzofuran-3-yl)acetamide has a molecular weight of 352.39 g/mol, XLogP of 3.04, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-amino-2-oxoethoxy)phenyl]-2-(6-ethyl-1-benzofuran-3-yl)acetamide is sourced from PubChem (CID 18167476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).