N-(2-methylpropyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide

C20H26N2O4S — CID 126119881

IUPACN-(2-methylpropyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide
SMILESCC(C)CNC(=O)COc1ccc(S(=O)(=O)NCCc2ccccc2)cc1
InChIInChI=1S/C20H26N2O4S/c1-16(2)14-21-20(23)15-26-18-8-10-19(11-9-18)27(24,25)22-13-12-17-6-4-3-5-7-17/h3-11,16,22H,12-15H2,1-2H3,(H,21,23)
InChIKeyHDZQLYMOWFBXKS-UHFFFAOYSA-N
MW390.51 g/mol
LogP2.36
Rot. Bonds10

About N-(2-methylpropyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide

N-(2-methylpropyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide (PubChem CID 126119881) has the molecular formula C20H26N2O4S and a molecular weight of 390.51 g/mol. Its IUPAC name is N-(2-methylpropyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide
PubChem CID126119881
Molecular FormulaC20H26N2O4S
Molecular Weight390.51 g/mol
Exact Mass390.16
IUPAC NameN-(2-methylpropyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide
SMILESCC(C)CNC(=O)COc1ccc(S(=O)(=O)NCCc2ccccc2)cc1
InChIInChI=1S/C20H26N2O4S/c1-16(2)14-21-20(23)15-26-18-8-10-19(11-9-18)27(24,25)22-13-12-17-6-4-3-5-7-17/h3-11,16,22H,12-15H2,1-2H3,(H,21,23)
InChIKeyHDZQLYMOWFBXKS-UHFFFAOYSA-N
XLogP2.36
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.51
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1S)-1-phenylethyl]-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide
CID 1314125
N-[1-(4-methylsulfanylphenyl)ethyl]-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide
CID 43873186
2-phenoxy-N-[4-(2-phenylethylsulfamoyl)phenyl]acetamide
CID 5187425
2-[4-[[(2S)-butan-2-yl]sulfamoyl]phenoxy]-N-(2-phenylethyl)acetamide
CID 7320182
2-(4-bromophenoxy)-N-[4-(2-phenylethylsulfamoyl)phenyl]acetamide
CID 5173418
N-(2,6-dichlorophenyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide
CID 126122414
N,N-dibenzyl-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide
CID 126117629
2-[4-[2-(benzenesulfonamido)ethyl]phenoxy]acetamide
CID 19388075
N-(2-cyanophenyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide
CID 122189465
2-naphthalen-2-yloxy-N-[4-(2-phenylethylsulfamoyl)phenyl]acetamide
CID 5169529
2-[4-(2-methylpropylsulfamoyl)phenoxy]-N-(pyridin-4-ylmethyl)acetamide
CID 11837026
2-[4-(benzylsulfamoyl)phenoxy]-N-methylacetamide
CID 126198035

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide?
The IUPAC name of N-(2-methylpropyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide (CID 126119881) is N-(2-methylpropyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide.
What is the SMILES notation for N-(2-methylpropyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide?
The canonical SMILES for N-(2-methylpropyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide is CC(C)CNC(=O)COc1ccc(S(=O)(=O)NCCc2ccccc2)cc1.
What is the InChIKey of N-(2-methylpropyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide?
The InChIKey is HDZQLYMOWFBXKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O4S/c1-16(2)14-21-20(23)15-26-18-8-10-19(11-9-18)27(24,25)22-13-12-17-6-4-3-5-7-17/h3-11,16,22H,12-15H2,1-2H3,(H,21,23).
What are the key properties of N-(2-methylpropyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide?
N-(2-methylpropyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide has a molecular weight of 390.51 g/mol, XLogP of 2.36, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-2-[4-(2-phenylethylsulfamoyl)phenoxy]acetamide is sourced from PubChem (CID 126119881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).