2-(2-tert-butylphenoxy)-N-[[4-(diethylsulfamoyl)phenyl]methyl]acetamide

C23H32N2O4S — CID 24549137

IUPAC2-(2-tert-butylphenoxy)-N-[[4-(diethylsulfamoyl)phenyl]methyl]acetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(CNC(=O)COc2ccccc2C(C)(C)C)cc1
InChIInChI=1S/C23H32N2O4S/c1-6-25(7-2)30(27,28)19-14-12-18(13-15-19)16-24-22(26)17-29-21-11-9-8-10-20(21)23(3,4)5/h8-15H,6-7,16-17H2,1-5H3,(H,24,26)
InChIKeyPBOYBGZWVPWGLT-UHFFFAOYSA-N
MW432.59 g/mol
LogP3.71
Rot. Bonds9

About 2-(2-tert-butylphenoxy)-N-[[4-(diethylsulfamoyl)phenyl]methyl]acetamide

2-(2-tert-butylphenoxy)-N-[[4-(diethylsulfamoyl)phenyl]methyl]acetamide (PubChem CID 24549137) has the molecular formula C23H32N2O4S and a molecular weight of 432.59 g/mol. Its IUPAC name is 2-(2-tert-butylphenoxy)-N-[[4-(diethylsulfamoyl)phenyl]methyl]acetamide.

Molecular Properties

Compound Name2-(2-tert-butylphenoxy)-N-[[4-(diethylsulfamoyl)phenyl]methyl]acetamide
PubChem CID24549137
Molecular FormulaC23H32N2O4S
Molecular Weight432.59 g/mol
Exact Mass432.21
IUPAC Name2-(2-tert-butylphenoxy)-N-[[4-(diethylsulfamoyl)phenyl]methyl]acetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(CNC(=O)COc2ccccc2C(C)(C)C)cc1
InChIInChI=1S/C23H32N2O4S/c1-6-25(7-2)30(27,28)19-14-12-18(13-15-19)16-24-22(26)17-29-21-11-9-8-10-20(21)23(3,4)5/h8-15H,6-7,16-17H2,1-5H3,(H,24,26)
InChIKeyPBOYBGZWVPWGLT-UHFFFAOYSA-N
XLogP3.71
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.59
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(2-tert-butylphenoxy)-N-[[4-(diethylsulfamoyl)phenyl]methyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2-tert-butylphenoxy)-N-[(4-methylphenyl)methyl]acetamide
CID 54776459
2-(2-tert-butylphenoxy)-N-[[4-[(dimethylamino)methyl]phenyl]methyl]acetamide
CID 31544159
N-[[4-(diethylsulfamoyl)phenyl]methyl]-2-(4-ethylphenoxy)acetamide
CID 26423148
2-(2-tert-butylphenoxy)-N-[4-(dipropylsulfamoyl)phenyl]acetamide
CID 17050666
2-[[2-(2-tert-butylphenoxy)acetyl]amino]acetate
CID 9170941
[2-[(4-fluorophenyl)methylamino]-2-oxoethyl] 4-(diethylsulfamoyl)benzoate
CID 2557279
N-[[4-(diethylsulfamoyl)phenyl]methyl]-3-(4-fluorophenyl)propanamide
CID 31747284
2-(2-tert-butylphenoxy)-N-[4-(dimethylsulfamoyl)phenyl]acetamide
CID 17050654
N-[[4-(diethylsulfamoyl)phenyl]methyl]-2-(2-methoxy-4-prop-2-enylphenoxy)acetamide
CID 26423489
1-benzyl-3-[[4-(diethylsulfamoyl)phenyl]methyl]urea
CID 41249851
2-[4-(diethylsulfamoyl)phenoxy]-N-[(3,4-dimethoxyphenyl)methyl]acetamide
CID 28554472
N-[[4-(diethylsulfamoyl)phenyl]methyl]-2-[2-methoxy-4-[(Z)-prop-1-enyl]phenoxy]acetamide
CID 97429002

Frequently Asked Questions

What is the IUPAC name of 2-(2-tert-butylphenoxy)-N-[[4-(diethylsulfamoyl)phenyl]methyl]acetamide?
The IUPAC name of 2-(2-tert-butylphenoxy)-N-[[4-(diethylsulfamoyl)phenyl]methyl]acetamide (CID 24549137) is 2-(2-tert-butylphenoxy)-N-[[4-(diethylsulfamoyl)phenyl]methyl]acetamide.
What is the SMILES notation for 2-(2-tert-butylphenoxy)-N-[[4-(diethylsulfamoyl)phenyl]methyl]acetamide?
The canonical SMILES for 2-(2-tert-butylphenoxy)-N-[[4-(diethylsulfamoyl)phenyl]methyl]acetamide is CCN(CC)S(=O)(=O)c1ccc(CNC(=O)COc2ccccc2C(C)(C)C)cc1.
What is the InChIKey of 2-(2-tert-butylphenoxy)-N-[[4-(diethylsulfamoyl)phenyl]methyl]acetamide?
The InChIKey is PBOYBGZWVPWGLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H32N2O4S/c1-6-25(7-2)30(27,28)19-14-12-18(13-15-19)16-24-22(26)17-29-21-11-9-8-10-20(21)23(3,4)5/h8-15H,6-7,16-17H2,1-5H3,(H,24,26).
What are the key properties of 2-(2-tert-butylphenoxy)-N-[[4-(diethylsulfamoyl)phenyl]methyl]acetamide?
2-(2-tert-butylphenoxy)-N-[[4-(diethylsulfamoyl)phenyl]methyl]acetamide has a molecular weight of 432.59 g/mol, XLogP of 3.71, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-tert-butylphenoxy)-N-[[4-(diethylsulfamoyl)phenyl]methyl]acetamide is sourced from PubChem (CID 24549137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).