N-(4-ethylphenyl)-2-[4-[(3-methylphenyl)sulfamoyl]phenoxy]acetamide

C23H24N2O4S — CID 3889761

IUPACN-(4-ethylphenyl)-2-[4-[(3-methylphenyl)sulfamoyl]phenoxy]acetamide
SMILESCCc1ccc(NC(=O)COc2ccc(S(=O)(=O)Nc3cccc(C)c3)cc2)cc1
InChIInChI=1S/C23H24N2O4S/c1-3-18-7-9-19(10-8-18)24-23(26)16-29-21-11-13-22(14-12-21)30(27,28)25-20-6-4-5-17(2)15-20/h4-15,25H,3,16H2,1-2H3,(H,24,26)
InChIKeyYGCHJNVRVKIICP-UHFFFAOYSA-N
MW424.52 g/mol
LogP4.38
Rot. Bonds8

About N-(4-ethylphenyl)-2-[4-[(3-methylphenyl)sulfamoyl]phenoxy]acetamide

N-(4-ethylphenyl)-2-[4-[(3-methylphenyl)sulfamoyl]phenoxy]acetamide (PubChem CID 3889761) has the molecular formula C23H24N2O4S and a molecular weight of 424.52 g/mol. Its IUPAC name is N-(4-ethylphenyl)-2-[4-[(3-methylphenyl)sulfamoyl]phenoxy]acetamide.

Molecular Properties

Compound NameN-(4-ethylphenyl)-2-[4-[(3-methylphenyl)sulfamoyl]phenoxy]acetamide
PubChem CID3889761
Molecular FormulaC23H24N2O4S
Molecular Weight424.52 g/mol
Exact Mass424.15
IUPAC NameN-(4-ethylphenyl)-2-[4-[(3-methylphenyl)sulfamoyl]phenoxy]acetamide
SMILESCCc1ccc(NC(=O)COc2ccc(S(=O)(=O)Nc3cccc(C)c3)cc2)cc1
InChIInChI=1S/C23H24N2O4S/c1-3-18-7-9-19(10-8-18)24-23(26)16-29-21-11-13-22(14-12-21)30(27,28)25-20-6-4-5-17(2)15-20/h4-15,25H,3,16H2,1-2H3,(H,24,26)
InChIKeyYGCHJNVRVKIICP-UHFFFAOYSA-N
XLogP4.38
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.52
LogP ≤ 54.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-ethylphenyl)-2-[4-[(3-methylphenyl)sulfamoyl]phenoxy]acetamide?
The IUPAC name of N-(4-ethylphenyl)-2-[4-[(3-methylphenyl)sulfamoyl]phenoxy]acetamide (CID 3889761) is N-(4-ethylphenyl)-2-[4-[(3-methylphenyl)sulfamoyl]phenoxy]acetamide.
What is the SMILES notation for N-(4-ethylphenyl)-2-[4-[(3-methylphenyl)sulfamoyl]phenoxy]acetamide?
The canonical SMILES for N-(4-ethylphenyl)-2-[4-[(3-methylphenyl)sulfamoyl]phenoxy]acetamide is CCc1ccc(NC(=O)COc2ccc(S(=O)(=O)Nc3cccc(C)c3)cc2)cc1.
What is the InChIKey of N-(4-ethylphenyl)-2-[4-[(3-methylphenyl)sulfamoyl]phenoxy]acetamide?
The InChIKey is YGCHJNVRVKIICP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O4S/c1-3-18-7-9-19(10-8-18)24-23(26)16-29-21-11-13-22(14-12-21)30(27,28)25-20-6-4-5-17(2)15-20/h4-15,25H,3,16H2,1-2H3,(H,24,26).
What are the key properties of N-(4-ethylphenyl)-2-[4-[(3-methylphenyl)sulfamoyl]phenoxy]acetamide?
N-(4-ethylphenyl)-2-[4-[(3-methylphenyl)sulfamoyl]phenoxy]acetamide has a molecular weight of 424.52 g/mol, XLogP of 4.38, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylphenyl)-2-[4-[(3-methylphenyl)sulfamoyl]phenoxy]acetamide is sourced from PubChem (CID 3889761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).