N-[2-(4-ethoxyphenoxy)phenyl]-5-(ethylsulfamoyl)-2-methylbenzamide

C24H26N2O5S — CID 39971961

IUPACN-[2-(4-ethoxyphenoxy)phenyl]-5-(ethylsulfamoyl)-2-methylbenzamide
SMILESCCNS(=O)(=O)c1ccc(C)c(C(=O)Nc2ccccc2Oc2ccc(OCC)cc2)c1
InChIInChI=1S/C24H26N2O5S/c1-4-25-32(28,29)20-15-10-17(3)21(16-20)24(27)26-22-8-6-7-9-23(22)31-19-13-11-18(12-14-19)30-5-2/h6-16,25H,4-5H2,1-3H3,(H,26,27)
InChIKeyMOQRDFPETBULIX-UHFFFAOYSA-N
MW454.55 g/mol
LogP4.74
Rot. Bonds9

About N-[2-(4-ethoxyphenoxy)phenyl]-5-(ethylsulfamoyl)-2-methylbenzamide

N-[2-(4-ethoxyphenoxy)phenyl]-5-(ethylsulfamoyl)-2-methylbenzamide (PubChem CID 39971961) has the molecular formula C24H26N2O5S and a molecular weight of 454.55 g/mol. Its IUPAC name is N-[2-(4-ethoxyphenoxy)phenyl]-5-(ethylsulfamoyl)-2-methylbenzamide.

Molecular Properties

Compound NameN-[2-(4-ethoxyphenoxy)phenyl]-5-(ethylsulfamoyl)-2-methylbenzamide
PubChem CID39971961
Molecular FormulaC24H26N2O5S
Molecular Weight454.55 g/mol
Exact Mass454.16
IUPAC NameN-[2-(4-ethoxyphenoxy)phenyl]-5-(ethylsulfamoyl)-2-methylbenzamide
SMILESCCNS(=O)(=O)c1ccc(C)c(C(=O)Nc2ccccc2Oc2ccc(OCC)cc2)c1
InChIInChI=1S/C24H26N2O5S/c1-4-25-32(28,29)20-15-10-17(3)21(16-20)24(27)26-22-8-6-7-9-23(22)31-19-13-11-18(12-14-19)30-5-2/h6-16,25H,4-5H2,1-3H3,(H,26,27)
InChIKeyMOQRDFPETBULIX-UHFFFAOYSA-N
XLogP4.74
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500454.55
LogP ≤ 54.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(cyclopropylsulfamoyl)-N-[2-(4-ethoxyphenoxy)phenyl]-2-methylbenzamide
CID 24585807
N-[2-(4-ethoxyphenoxy)phenyl]-4-(ethylsulfamoyl)benzamide
CID 39971958
N-(2-chlorophenyl)-5-(ethylsulfamoyl)-2-methylbenzamide
CID 35345609
[2-(2-ethoxyanilino)-2-oxoethyl] 5-(ethylsulfamoyl)-2-methylbenzoate
CID 31866861
N-[2-(ethylaminomethyl)phenyl]-5-(ethylsulfamoyl)-2-methylbenzamide
CID 119438951
N-[2-[(4-tert-butylbenzoyl)amino]phenyl]-5-(ethylsulfamoyl)-2-methylbenzamide
CID 31971087
N-[2-(ethylaminomethyl)phenyl]-5-(ethylsulfamoyl)-2-methylbenzamide;hydrochloride
CID 119438950
N-(4-ethoxyphenyl)-2-methyl-5-(methylsulfamoyl)benzamide
CID 51297742
N-[2-(4-ethoxyphenoxy)phenyl]-2-iodobenzamide
CID 26243693
5-(ethylsulfamoyl)-2-methyl-N-[6-(4-methylphenoxy)-3-pyridinyl]benzamide
CID 55971765
N-(5-chloro-2-methylphenyl)-5-(ethylsulfamoyl)-2-methylbenzamide
CID 43007142
5-(ethylsulfamoyl)-2-methyl-N-(2,4,5-trimethoxy-3-methylphenyl)benzamide
CID 100636430

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-ethoxyphenoxy)phenyl]-5-(ethylsulfamoyl)-2-methylbenzamide?
The IUPAC name of N-[2-(4-ethoxyphenoxy)phenyl]-5-(ethylsulfamoyl)-2-methylbenzamide (CID 39971961) is N-[2-(4-ethoxyphenoxy)phenyl]-5-(ethylsulfamoyl)-2-methylbenzamide.
What is the SMILES notation for N-[2-(4-ethoxyphenoxy)phenyl]-5-(ethylsulfamoyl)-2-methylbenzamide?
The canonical SMILES for N-[2-(4-ethoxyphenoxy)phenyl]-5-(ethylsulfamoyl)-2-methylbenzamide is CCNS(=O)(=O)c1ccc(C)c(C(=O)Nc2ccccc2Oc2ccc(OCC)cc2)c1.
What is the InChIKey of N-[2-(4-ethoxyphenoxy)phenyl]-5-(ethylsulfamoyl)-2-methylbenzamide?
The InChIKey is MOQRDFPETBULIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O5S/c1-4-25-32(28,29)20-15-10-17(3)21(16-20)24(27)26-22-8-6-7-9-23(22)31-19-13-11-18(12-14-19)30-5-2/h6-16,25H,4-5H2,1-3H3,(H,26,27).
What are the key properties of N-[2-(4-ethoxyphenoxy)phenyl]-5-(ethylsulfamoyl)-2-methylbenzamide?
N-[2-(4-ethoxyphenoxy)phenyl]-5-(ethylsulfamoyl)-2-methylbenzamide has a molecular weight of 454.55 g/mol, XLogP of 4.74, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-ethoxyphenoxy)phenyl]-5-(ethylsulfamoyl)-2-methylbenzamide is sourced from PubChem (CID 39971961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).