2-(4-methoxyphenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide

C19H22N2O6S — CID 646975

IUPAC2-(4-methoxyphenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide
SMILESCOc1ccc(OCC(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1
InChIInChI=1S/C19H22N2O6S/c1-25-16-4-6-17(7-5-16)27-14-19(22)20-15-2-8-18(9-3-15)28(23,24)21-10-12-26-13-11-21/h2-9H,10-14H2,1H3,(H,20,22)
InChIKeyJFTOITOBGNPCQU-UHFFFAOYSA-N
MW406.46 g/mol
LogP1.73
Rot. Bonds7

About 2-(4-methoxyphenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide

2-(4-methoxyphenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide (PubChem CID 646975) has the molecular formula C19H22N2O6S and a molecular weight of 406.46 g/mol. Its IUPAC name is 2-(4-methoxyphenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-methoxyphenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide
PubChem CID646975
Molecular FormulaC19H22N2O6S
Molecular Weight406.46 g/mol
Exact Mass406.12
IUPAC Name2-(4-methoxyphenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide
SMILESCOc1ccc(OCC(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1
InChIInChI=1S/C19H22N2O6S/c1-25-16-4-6-17(7-5-16)27-14-19(22)20-15-2-8-18(9-3-15)28(23,24)21-10-12-26-13-11-21/h2-9H,10-14H2,1H3,(H,20,22)
InChIKeyJFTOITOBGNPCQU-UHFFFAOYSA-N
XLogP1.73
TPSA94.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.46
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide?
The IUPAC name of 2-(4-methoxyphenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide (CID 646975) is 2-(4-methoxyphenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide.
What is the SMILES notation for 2-(4-methoxyphenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide?
The canonical SMILES for 2-(4-methoxyphenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide is COc1ccc(OCC(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1.
What is the InChIKey of 2-(4-methoxyphenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide?
The InChIKey is JFTOITOBGNPCQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O6S/c1-25-16-4-6-17(7-5-16)27-14-19(22)20-15-2-8-18(9-3-15)28(23,24)21-10-12-26-13-11-21/h2-9H,10-14H2,1H3,(H,20,22).
What are the key properties of 2-(4-methoxyphenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide?
2-(4-methoxyphenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide has a molecular weight of 406.46 g/mol, XLogP of 1.73, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenoxy)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide is sourced from PubChem (CID 646975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).