3-(2-chlorophenoxy)-N-[4-(2-phenylethylsulfamoyl)phenyl]propanamide

C23H23ClN2O4S — CID 108802323

IUPAC3-(2-chlorophenoxy)-N-[4-(2-phenylethylsulfamoyl)phenyl]propanamide
SMILESO=C(CCOc1ccccc1Cl)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1
InChIInChI=1S/C23H23ClN2O4S/c24-21-8-4-5-9-22(21)30-17-15-23(27)26-19-10-12-20(13-11-19)31(28,29)25-16-14-18-6-2-1-3-7-18/h1-13,25H,14-17H2,(H,26,27)
InChIKeyMBZLJAQXGRGBLH-UHFFFAOYSA-N
MW458.97 g/mol
LogP4.27
Rot. Bonds10

About 3-(2-chlorophenoxy)-N-[4-(2-phenylethylsulfamoyl)phenyl]propanamide

3-(2-chlorophenoxy)-N-[4-(2-phenylethylsulfamoyl)phenyl]propanamide (PubChem CID 108802323) has the molecular formula C23H23ClN2O4S and a molecular weight of 458.97 g/mol. Its IUPAC name is 3-(2-chlorophenoxy)-N-[4-(2-phenylethylsulfamoyl)phenyl]propanamide.

Molecular Properties

Compound Name3-(2-chlorophenoxy)-N-[4-(2-phenylethylsulfamoyl)phenyl]propanamide
PubChem CID108802323
Molecular FormulaC23H23ClN2O4S
Molecular Weight458.97 g/mol
Exact Mass458.11
IUPAC Name3-(2-chlorophenoxy)-N-[4-(2-phenylethylsulfamoyl)phenyl]propanamide
SMILESO=C(CCOc1ccccc1Cl)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1
InChIInChI=1S/C23H23ClN2O4S/c24-21-8-4-5-9-22(21)30-17-15-23(27)26-19-10-12-20(13-11-19)31(28,29)25-16-14-18-6-2-1-3-7-18/h1-13,25H,14-17H2,(H,26,27)
InChIKeyMBZLJAQXGRGBLH-UHFFFAOYSA-N
XLogP4.27
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500458.97
LogP ≤ 54.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-chloro-N-[4-(2-phenylethylsulfamoyl)phenyl]butanamide
CID 17160952
3-(4-ethylphenoxy)-N-[4-(2-phenylethylsulfamoyl)phenyl]propanamide
CID 108807272
2-phenoxy-N-[4-(2-phenylethylsulfamoyl)phenyl]acetamide
CID 5187425
3-[(4-bromophenyl)sulfonylamino]-N-[4-(2-phenylethylsulfamoyl)phenyl]propanamide
CID 17192480
4-oxo-4-phenyl-N-[4-(2-phenylethylsulfamoyl)phenyl]butanamide
CID 108807364
N-[4-(2-phenylethylsulfamoyl)phenyl]heptanamide
CID 54790596
N-[3-oxo-3-[4-(2-phenylethylsulfamoyl)anilino]propyl]benzamide
CID 17154573
N-[4-(benzylsulfamoyl)phenyl]-3-(2-chlorophenyl)propanamide
CID 17178995
N-(4-bromophenyl)-3-(2-chlorophenoxy)propanamide
CID 108789381
3-(2-chlorophenoxy)-N-(4-methylphenyl)propanamide
CID 39087955
2-cyano-N-[4-(2-phenylethylsulfamoyl)phenyl]acetamide
CID 168522081
2-(4-bromophenoxy)-N-[4-(2-phenylethylsulfamoyl)phenyl]acetamide
CID 5173418

Frequently Asked Questions

What is the IUPAC name of 3-(2-chlorophenoxy)-N-[4-(2-phenylethylsulfamoyl)phenyl]propanamide?
The IUPAC name of 3-(2-chlorophenoxy)-N-[4-(2-phenylethylsulfamoyl)phenyl]propanamide (CID 108802323) is 3-(2-chlorophenoxy)-N-[4-(2-phenylethylsulfamoyl)phenyl]propanamide.
What is the SMILES notation for 3-(2-chlorophenoxy)-N-[4-(2-phenylethylsulfamoyl)phenyl]propanamide?
The canonical SMILES for 3-(2-chlorophenoxy)-N-[4-(2-phenylethylsulfamoyl)phenyl]propanamide is O=C(CCOc1ccccc1Cl)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1.
What is the InChIKey of 3-(2-chlorophenoxy)-N-[4-(2-phenylethylsulfamoyl)phenyl]propanamide?
The InChIKey is MBZLJAQXGRGBLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23ClN2O4S/c24-21-8-4-5-9-22(21)30-17-15-23(27)26-19-10-12-20(13-11-19)31(28,29)25-16-14-18-6-2-1-3-7-18/h1-13,25H,14-17H2,(H,26,27).
What are the key properties of 3-(2-chlorophenoxy)-N-[4-(2-phenylethylsulfamoyl)phenyl]propanamide?
3-(2-chlorophenoxy)-N-[4-(2-phenylethylsulfamoyl)phenyl]propanamide has a molecular weight of 458.97 g/mol, XLogP of 4.27, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-chlorophenoxy)-N-[4-(2-phenylethylsulfamoyl)phenyl]propanamide is sourced from PubChem (CID 108802323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).