2-(4-acetylphenoxy)-N-[4-(phenylsulfamoyl)phenyl]propanamide

C23H22N2O5S — CID 24638155

IUPAC2-(4-acetylphenoxy)-N-[4-(phenylsulfamoyl)phenyl]propanamide
SMILESCC(=O)c1ccc(OC(C)C(=O)Nc2ccc(S(=O)(=O)Nc3ccccc3)cc2)cc1
InChIInChI=1S/C23H22N2O5S/c1-16(26)18-8-12-21(13-9-18)30-17(2)23(27)24-19-10-14-22(15-11-19)31(28,29)25-20-6-4-3-5-7-20/h3-15,17,25H,1-2H3,(H,24,27)
InChIKeyBVVMKXBVPCMSDD-UHFFFAOYSA-N
MW438.51 g/mol
LogP4.10
Rot. Bonds8

About 2-(4-acetylphenoxy)-N-[4-(phenylsulfamoyl)phenyl]propanamide

2-(4-acetylphenoxy)-N-[4-(phenylsulfamoyl)phenyl]propanamide (PubChem CID 24638155) has the molecular formula C23H22N2O5S and a molecular weight of 438.51 g/mol. Its IUPAC name is 2-(4-acetylphenoxy)-N-[4-(phenylsulfamoyl)phenyl]propanamide.

Molecular Properties

Compound Name2-(4-acetylphenoxy)-N-[4-(phenylsulfamoyl)phenyl]propanamide
PubChem CID24638155
Molecular FormulaC23H22N2O5S
Molecular Weight438.51 g/mol
Exact Mass438.12
IUPAC Name2-(4-acetylphenoxy)-N-[4-(phenylsulfamoyl)phenyl]propanamide
SMILESCC(=O)c1ccc(OC(C)C(=O)Nc2ccc(S(=O)(=O)Nc3ccccc3)cc2)cc1
InChIInChI=1S/C23H22N2O5S/c1-16(26)18-8-12-21(13-9-18)30-17(2)23(27)24-19-10-14-22(15-11-19)31(28,29)25-20-6-4-3-5-7-20/h3-15,17,25H,1-2H3,(H,24,27)
InChIKeyBVVMKXBVPCMSDD-UHFFFAOYSA-N
XLogP4.10
TPSA101.57 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500438.51
LogP ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-phenoxy-N-[4-(phenylsulfamoyl)phenyl]propanamide
CID 4939919
(2R)-2-(4-methoxyphenoxy)-N-[4-(phenylsulfamoyl)phenyl]propanamide
CID 41479035
(2R)-2-(4-methylphenoxy)-N-[4-(phenylsulfamoyl)phenyl]propanamide
CID 41269416
(2R)-2-(4-acetylphenoxy)-N-[4-(propan-2-ylsulfamoyl)phenyl]propanamide
CID 7763890
N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]-2-phenoxypropanamide
CID 4939891
(2S)-2-(4-methoxyphenoxy)-N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]propanamide
CID 42063919
(2R)-N-methyl-2-[4-(phenylsulfamoyl)phenoxy]propanamide
CID 92513136
[1-(4-acetylanilino)-1-oxopropan-2-yl] 4-[(4-methoxyphenyl)sulfamoyl]benzoate
CID 42966975
(2R)-N-(4-acetylphenyl)-2-(4-iodophenoxy)propanamide
CID 1222649
2-phenoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]propanamide
CID 3148025
N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]-2-(4-propan-2-ylphenoxy)propanamide
CID 4953580
N-[4-(phenylsulfamoyl)phenyl]-2-(2-propan-2-ylphenoxy)propanamide
CID 43915337

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetylphenoxy)-N-[4-(phenylsulfamoyl)phenyl]propanamide?
The IUPAC name of 2-(4-acetylphenoxy)-N-[4-(phenylsulfamoyl)phenyl]propanamide (CID 24638155) is 2-(4-acetylphenoxy)-N-[4-(phenylsulfamoyl)phenyl]propanamide.
What is the SMILES notation for 2-(4-acetylphenoxy)-N-[4-(phenylsulfamoyl)phenyl]propanamide?
The canonical SMILES for 2-(4-acetylphenoxy)-N-[4-(phenylsulfamoyl)phenyl]propanamide is CC(=O)c1ccc(OC(C)C(=O)Nc2ccc(S(=O)(=O)Nc3ccccc3)cc2)cc1.
What is the InChIKey of 2-(4-acetylphenoxy)-N-[4-(phenylsulfamoyl)phenyl]propanamide?
The InChIKey is BVVMKXBVPCMSDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O5S/c1-16(26)18-8-12-21(13-9-18)30-17(2)23(27)24-19-10-14-22(15-11-19)31(28,29)25-20-6-4-3-5-7-20/h3-15,17,25H,1-2H3,(H,24,27).
What are the key properties of 2-(4-acetylphenoxy)-N-[4-(phenylsulfamoyl)phenyl]propanamide?
2-(4-acetylphenoxy)-N-[4-(phenylsulfamoyl)phenyl]propanamide has a molecular weight of 438.51 g/mol, XLogP of 4.10, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetylphenoxy)-N-[4-(phenylsulfamoyl)phenyl]propanamide is sourced from PubChem (CID 24638155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).