2-(6-methoxy-1-benzofuran-3-yl)-N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)acetamide

C22H24N2O7S — CID 51532771

IUPAC2-(6-methoxy-1-benzofuran-3-yl)-N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)acetamide
SMILESCOc1ccc2c(CC(=O)Nc3cc(S(=O)(=O)N4CCOCC4)ccc3OC)coc2c1
InChIInChI=1S/C22H24N2O7S/c1-28-16-3-5-18-15(14-31-21(18)12-16)11-22(25)23-19-13-17(4-6-20(19)29-2)32(26,27)24-7-9-30-10-8-24/h3-6,12-14H,7-11H2,1-2H3,(H,23,25)
InChIKeyCKTZTDMFYDDCRG-UHFFFAOYSA-N
MW460.51 g/mol
LogP2.65
Rot. Bonds7

About 2-(6-methoxy-1-benzofuran-3-yl)-N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)acetamide

2-(6-methoxy-1-benzofuran-3-yl)-N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)acetamide (PubChem CID 51532771) has the molecular formula C22H24N2O7S and a molecular weight of 460.51 g/mol. Its IUPAC name is 2-(6-methoxy-1-benzofuran-3-yl)-N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)acetamide.

Molecular Properties

Compound Name2-(6-methoxy-1-benzofuran-3-yl)-N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)acetamide
PubChem CID51532771
Molecular FormulaC22H24N2O7S
Molecular Weight460.51 g/mol
Exact Mass460.13
IUPAC Name2-(6-methoxy-1-benzofuran-3-yl)-N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)acetamide
SMILESCOc1ccc2c(CC(=O)Nc3cc(S(=O)(=O)N4CCOCC4)ccc3OC)coc2c1
InChIInChI=1S/C22H24N2O7S/c1-28-16-3-5-18-15(14-31-21(18)12-16)11-22(25)23-19-13-17(4-6-20(19)29-2)32(26,27)24-7-9-30-10-8-24/h3-6,12-14H,7-11H2,1-2H3,(H,23,25)
InChIKeyCKTZTDMFYDDCRG-UHFFFAOYSA-N
XLogP2.65
TPSA107.31 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500460.51
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

2-(6-methoxy-1-benzofuran-3-yl)-N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)acetamide
CID 26065721
N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-(3-methoxyphenyl)acetamide
CID 7998229
2-(6-methoxy-1-benzofuran-3-yl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide
CID 3971736
2-(2-chlorophenyl)-N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)acetamide
CID 15944808
N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-ylacetamide
CID 26065527
N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylsulfanylacetamide
CID 8746733
2-(6-methoxy-1-benzofuran-3-yl)-N-(2-methoxy-5-nitrophenyl)acetamide
CID 17450420
2-(4-methoxyphenyl)-N-(2-methoxy-5-pyrrolidin-1-ylsulfonylphenyl)acetamide
CID 92678134
N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylpropanamide
CID 8746778
2-(azepan-1-yl)-N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)acetamide
CID 4965549
N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-2-(4-methoxyphenyl)acetamide
CID 4787017
4-(4-ethoxyphenoxy)-N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)butanamide
CID 4688141

Frequently Asked Questions

What is the IUPAC name of 2-(6-methoxy-1-benzofuran-3-yl)-N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)acetamide?
The IUPAC name of 2-(6-methoxy-1-benzofuran-3-yl)-N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)acetamide (CID 51532771) is 2-(6-methoxy-1-benzofuran-3-yl)-N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)acetamide.
What is the SMILES notation for 2-(6-methoxy-1-benzofuran-3-yl)-N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)acetamide?
The canonical SMILES for 2-(6-methoxy-1-benzofuran-3-yl)-N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)acetamide is COc1ccc2c(CC(=O)Nc3cc(S(=O)(=O)N4CCOCC4)ccc3OC)coc2c1.
What is the InChIKey of 2-(6-methoxy-1-benzofuran-3-yl)-N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)acetamide?
The InChIKey is CKTZTDMFYDDCRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O7S/c1-28-16-3-5-18-15(14-31-21(18)12-16)11-22(25)23-19-13-17(4-6-20(19)29-2)32(26,27)24-7-9-30-10-8-24/h3-6,12-14H,7-11H2,1-2H3,(H,23,25).
What are the key properties of 2-(6-methoxy-1-benzofuran-3-yl)-N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)acetamide?
2-(6-methoxy-1-benzofuran-3-yl)-N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)acetamide has a molecular weight of 460.51 g/mol, XLogP of 2.65, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methoxy-1-benzofuran-3-yl)-N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)acetamide is sourced from PubChem (CID 51532771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).