N-[(4-methylphenyl)methyl]-2-[4-(1-phenylethylsulfamoyl)phenoxy]acetamide

C24H26N2O4S — CID 4270828

IUPACN-[(4-methylphenyl)methyl]-2-[4-(1-phenylethylsulfamoyl)phenoxy]acetamide
SMILESCc1ccc(CNC(=O)COc2ccc(S(=O)(=O)NC(C)c3ccccc3)cc2)cc1
InChIInChI=1S/C24H26N2O4S/c1-18-8-10-20(11-9-18)16-25-24(27)17-30-22-12-14-23(15-13-22)31(28,29)26-19(2)21-6-4-3-5-7-21/h3-15,19,26H,16-17H2,1-2H3,(H,25,27)
InChIKeyNVFZULUAGGZWOF-UHFFFAOYSA-N
MW438.55 g/mol
LogP3.73
Rot. Bonds9

About N-[(4-methylphenyl)methyl]-2-[4-(1-phenylethylsulfamoyl)phenoxy]acetamide

N-[(4-methylphenyl)methyl]-2-[4-(1-phenylethylsulfamoyl)phenoxy]acetamide (PubChem CID 4270828) has the molecular formula C24H26N2O4S and a molecular weight of 438.55 g/mol. Its IUPAC name is N-[(4-methylphenyl)methyl]-2-[4-(1-phenylethylsulfamoyl)phenoxy]acetamide.

Molecular Properties

Compound NameN-[(4-methylphenyl)methyl]-2-[4-(1-phenylethylsulfamoyl)phenoxy]acetamide
PubChem CID4270828
Molecular FormulaC24H26N2O4S
Molecular Weight438.55 g/mol
Exact Mass438.16
IUPAC NameN-[(4-methylphenyl)methyl]-2-[4-(1-phenylethylsulfamoyl)phenoxy]acetamide
SMILESCc1ccc(CNC(=O)COc2ccc(S(=O)(=O)NC(C)c3ccccc3)cc2)cc1
InChIInChI=1S/C24H26N2O4S/c1-18-8-10-20(11-9-18)16-25-24(27)17-30-22-12-14-23(15-13-22)31(28,29)26-19(2)21-6-4-3-5-7-21/h3-15,19,26H,16-17H2,1-2H3,(H,25,27)
InChIKeyNVFZULUAGGZWOF-UHFFFAOYSA-N
XLogP3.73
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500438.55
LogP ≤ 53.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-benzyl-2-[4-[[(1R)-1-phenylethyl]sulfamoyl]phenoxy]acetamide
CID 1317169
N-[(4-methoxyphenyl)methyl]-2-[4-[[(1S)-1-phenylethyl]sulfamoyl]phenoxy]acetamide
CID 1304675
N-[(4-methylphenyl)methyl]-2-[4-(propan-2-ylsulfamoyl)phenoxy]acetamide
CID 1319379
N-[2-(4-methoxyphenyl)ethyl]-2-[4-(1-phenylethylsulfamoyl)phenoxy]acetamide
CID 4197939
2-[4-[[(1S)-1-phenylethyl]sulfamoyl]phenoxy]-N-propan-2-ylacetamide
CID 1006268
N-(2-methoxyethyl)-2-[4-(1-phenylethylsulfamoyl)phenoxy]acetamide
CID 4548292
N-tert-butyl-2-[4-[[(1R)-1-phenylethyl]sulfamoyl]phenoxy]acetamide
CID 126152898
N-phenyl-2-[4-[[(1S)-1-phenylethyl]sulfamoyl]phenoxy]acetamide
CID 126130695
N-(2,6-dimethylphenyl)-2-[4-[[(1R)-1-phenylethyl]sulfamoyl]phenoxy]acetamide
CID 126133986
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[4-[[(1S)-1-phenylethyl]sulfamoyl]phenoxy]acetamide
CID 42563714
N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-[4-[[(1R)-1-phenylethyl]sulfamoyl]phenoxy]acetamide
CID 28552297
2-(4-methylphenoxy)-N-[(4-propan-2-yloxyphenyl)methyl]acetamide
CID 43911022

Frequently Asked Questions

What is the IUPAC name of N-[(4-methylphenyl)methyl]-2-[4-(1-phenylethylsulfamoyl)phenoxy]acetamide?
The IUPAC name of N-[(4-methylphenyl)methyl]-2-[4-(1-phenylethylsulfamoyl)phenoxy]acetamide (CID 4270828) is N-[(4-methylphenyl)methyl]-2-[4-(1-phenylethylsulfamoyl)phenoxy]acetamide.
What is the SMILES notation for N-[(4-methylphenyl)methyl]-2-[4-(1-phenylethylsulfamoyl)phenoxy]acetamide?
The canonical SMILES for N-[(4-methylphenyl)methyl]-2-[4-(1-phenylethylsulfamoyl)phenoxy]acetamide is Cc1ccc(CNC(=O)COc2ccc(S(=O)(=O)NC(C)c3ccccc3)cc2)cc1.
What is the InChIKey of N-[(4-methylphenyl)methyl]-2-[4-(1-phenylethylsulfamoyl)phenoxy]acetamide?
The InChIKey is NVFZULUAGGZWOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O4S/c1-18-8-10-20(11-9-18)16-25-24(27)17-30-22-12-14-23(15-13-22)31(28,29)26-19(2)21-6-4-3-5-7-21/h3-15,19,26H,16-17H2,1-2H3,(H,25,27).
What are the key properties of N-[(4-methylphenyl)methyl]-2-[4-(1-phenylethylsulfamoyl)phenoxy]acetamide?
N-[(4-methylphenyl)methyl]-2-[4-(1-phenylethylsulfamoyl)phenoxy]acetamide has a molecular weight of 438.55 g/mol, XLogP of 3.73, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methylphenyl)methyl]-2-[4-(1-phenylethylsulfamoyl)phenoxy]acetamide is sourced from PubChem (CID 4270828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).