2-(6,7-dimethyl-1-benzofuran-3-yl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]acetamide

C23H26N2O4 — CID 26352767

IUPAC2-(6,7-dimethyl-1-benzofuran-3-yl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]acetamide
SMILESCCN(CC(=O)Nc1cccc(OC)c1)C(=O)Cc1coc2c(C)c(C)ccc12
InChIInChI=1S/C23H26N2O4/c1-5-25(13-21(26)24-18-7-6-8-19(12-18)28-4)22(27)11-17-14-29-23-16(3)15(2)9-10-20(17)23/h6-10,12,14H,5,11,13H2,1-4H3,(H,24,26)
InChIKeyILZGNGZHZNXKOK-UHFFFAOYSA-N
MW394.47 g/mol
LogP4.09
Rot. Bonds7

About 2-(6,7-dimethyl-1-benzofuran-3-yl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]acetamide

2-(6,7-dimethyl-1-benzofuran-3-yl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]acetamide (PubChem CID 26352767) has the molecular formula C23H26N2O4 and a molecular weight of 394.47 g/mol. Its IUPAC name is 2-(6,7-dimethyl-1-benzofuran-3-yl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]acetamide.

Molecular Properties

Compound Name2-(6,7-dimethyl-1-benzofuran-3-yl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]acetamide
PubChem CID26352767
Molecular FormulaC23H26N2O4
Molecular Weight394.47 g/mol
Exact Mass394.19
IUPAC Name2-(6,7-dimethyl-1-benzofuran-3-yl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]acetamide
SMILESCCN(CC(=O)Nc1cccc(OC)c1)C(=O)Cc1coc2c(C)c(C)ccc12
InChIInChI=1S/C23H26N2O4/c1-5-25(13-21(26)24-18-7-6-8-19(12-18)28-4)22(27)11-17-14-29-23-16(3)15(2)9-10-20(17)23/h6-10,12,14H,5,11,13H2,1-4H3,(H,24,26)
InChIKeyILZGNGZHZNXKOK-UHFFFAOYSA-N
XLogP4.09
TPSA71.78 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.47
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(6,7-dimethyl-1-benzofuran-3-yl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]acetamide with MolForge

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Related Compounds

2-benzo[e][1]benzofuran-1-yl-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]acetamide
CID 9094777
N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]propanamide
CID 43011197
2-(6,7-dimethyl-1-benzofuran-3-yl)-N-[2-(3-fluoroanilino)-2-oxoethyl]-N-methylacetamide
CID 9439235
N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]-3,3-dimethylbutanamide
CID 43011201
N-[2-[ethyl-[2-(3-methoxyanilino)-2-oxoethyl]amino]-2-oxoethyl]-3,5-dimethylbenzamide
CID 46582138
2-[ethyl-(2-phenoxyacetyl)amino]-N-(3-methoxyphenyl)acetamide
CID 9094787
2-[[2-(2-ethoxyphenoxy)acetyl]-ethylamino]-N-(3-methoxyphenyl)acetamide
CID 7958649
4-amino-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]pentanamide
CID 120559009
N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]-4-(5-methylthiophen-2-yl)-4-oxobutanamide
CID 78797825
N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]-3-(pyrimidin-2-ylamino)propanamide
CID 55702362
3-(2-chlorophenyl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]propanamide
CID 34778531
2-[[2-(3-chlorophenoxy)acetyl]-ethylamino]-N-(3-methoxyphenyl)acetamide
CID 34778386

Frequently Asked Questions

What is the IUPAC name of 2-(6,7-dimethyl-1-benzofuran-3-yl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]acetamide?
The IUPAC name of 2-(6,7-dimethyl-1-benzofuran-3-yl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]acetamide (CID 26352767) is 2-(6,7-dimethyl-1-benzofuran-3-yl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]acetamide.
What is the SMILES notation for 2-(6,7-dimethyl-1-benzofuran-3-yl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]acetamide?
The canonical SMILES for 2-(6,7-dimethyl-1-benzofuran-3-yl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]acetamide is CCN(CC(=O)Nc1cccc(OC)c1)C(=O)Cc1coc2c(C)c(C)ccc12.
What is the InChIKey of 2-(6,7-dimethyl-1-benzofuran-3-yl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]acetamide?
The InChIKey is ILZGNGZHZNXKOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N2O4/c1-5-25(13-21(26)24-18-7-6-8-19(12-18)28-4)22(27)11-17-14-29-23-16(3)15(2)9-10-20(17)23/h6-10,12,14H,5,11,13H2,1-4H3,(H,24,26).
What are the key properties of 2-(6,7-dimethyl-1-benzofuran-3-yl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]acetamide?
2-(6,7-dimethyl-1-benzofuran-3-yl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]acetamide has a molecular weight of 394.47 g/mol, XLogP of 4.09, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6,7-dimethyl-1-benzofuran-3-yl)-N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]acetamide is sourced from PubChem (CID 26352767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).