2-[4-[(4-chlorophenyl)sulfamoyl]phenoxy]-N-cyclohexylacetamide

C20H23ClN2O4S — CID 3886490

IUPAC2-[4-[(4-chlorophenyl)sulfamoyl]phenoxy]-N-cyclohexylacetamide
SMILESO=C(COc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2)cc1)NC1CCCCC1
InChIInChI=1S/C20H23ClN2O4S/c21-15-6-8-17(9-7-15)23-28(25,26)19-12-10-18(11-13-19)27-14-20(24)22-16-4-2-1-3-5-16/h6-13,16,23H,1-5,14H2,(H,22,24)
InChIKeyBMAAGKCACXPOKA-UHFFFAOYSA-N
MW422.93 g/mol
LogP3.97
Rot. Bonds7

About 2-[4-[(4-chlorophenyl)sulfamoyl]phenoxy]-N-cyclohexylacetamide

2-[4-[(4-chlorophenyl)sulfamoyl]phenoxy]-N-cyclohexylacetamide (PubChem CID 3886490) has the molecular formula C20H23ClN2O4S and a molecular weight of 422.93 g/mol. Its IUPAC name is 2-[4-[(4-chlorophenyl)sulfamoyl]phenoxy]-N-cyclohexylacetamide.

Molecular Properties

Compound Name2-[4-[(4-chlorophenyl)sulfamoyl]phenoxy]-N-cyclohexylacetamide
PubChem CID3886490
Molecular FormulaC20H23ClN2O4S
Molecular Weight422.93 g/mol
Exact Mass422.11
IUPAC Name2-[4-[(4-chlorophenyl)sulfamoyl]phenoxy]-N-cyclohexylacetamide
SMILESO=C(COc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2)cc1)NC1CCCCC1
InChIInChI=1S/C20H23ClN2O4S/c21-15-6-8-17(9-7-15)23-28(25,26)19-12-10-18(11-13-19)27-14-20(24)22-16-4-2-1-3-5-16/h6-13,16,23H,1-5,14H2,(H,22,24)
InChIKeyBMAAGKCACXPOKA-UHFFFAOYSA-N
XLogP3.97
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.93
LogP ≤ 53.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-chlorophenoxy)-N-cyclooctylacetamide
CID 875180
N-(4-chlorophenyl)-2-[4-(cyclohexylsulfamoyl)phenoxy]acetamide
CID 45374352
N-cyclopentyl-2-[4-[(3,5-dimethylphenyl)sulfamoyl]phenoxy]acetamide
CID 4574357
2-[4-[(4-chlorophenyl)sulfamoyl]phenoxy]-N-ethylacetamide
CID 4238795
[2-(cyclopentylamino)-2-oxoethyl] 2-chloro-5-[(4-chlorophenyl)sulfamoyl]benzoate
CID 2366758
2-[4-[[(2R)-butan-2-yl]sulfamoyl]phenoxy]-N-cycloheptylacetamide
CID 1307702
N-cycloheptyl-2-[4-(methylamino)phenoxy]acetamide
CID 61027576
2-(4-chlorophenoxy)-N-[4-[cyclohexyl(methyl)sulfamoyl]phenyl]acetamide
CID 4924171
N-cyclohexyl-2-(4-iodophenoxy)acetamide
CID 1313853
2-(4-chlorophenoxy)-N-[3-[[2-(4-chlorophenoxy)acetyl]amino]cyclopentyl]acetamide
CID 177253885
2-(4-acetamidophenoxy)-N-cyclooctylacetamide
CID 112774945
N-[4-[[2-(4-chlorophenoxy)acetyl]amino]cyclohexyl]-2-(4-methoxyphenoxy)acetamide
CID 121260490

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(4-chlorophenyl)sulfamoyl]phenoxy]-N-cyclohexylacetamide?
The IUPAC name of 2-[4-[(4-chlorophenyl)sulfamoyl]phenoxy]-N-cyclohexylacetamide (CID 3886490) is 2-[4-[(4-chlorophenyl)sulfamoyl]phenoxy]-N-cyclohexylacetamide.
What is the SMILES notation for 2-[4-[(4-chlorophenyl)sulfamoyl]phenoxy]-N-cyclohexylacetamide?
The canonical SMILES for 2-[4-[(4-chlorophenyl)sulfamoyl]phenoxy]-N-cyclohexylacetamide is O=C(COc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2)cc1)NC1CCCCC1.
What is the InChIKey of 2-[4-[(4-chlorophenyl)sulfamoyl]phenoxy]-N-cyclohexylacetamide?
The InChIKey is BMAAGKCACXPOKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23ClN2O4S/c21-15-6-8-17(9-7-15)23-28(25,26)19-12-10-18(11-13-19)27-14-20(24)22-16-4-2-1-3-5-16/h6-13,16,23H,1-5,14H2,(H,22,24).
What are the key properties of 2-[4-[(4-chlorophenyl)sulfamoyl]phenoxy]-N-cyclohexylacetamide?
2-[4-[(4-chlorophenyl)sulfamoyl]phenoxy]-N-cyclohexylacetamide has a molecular weight of 422.93 g/mol, XLogP of 3.97, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(4-chlorophenyl)sulfamoyl]phenoxy]-N-cyclohexylacetamide is sourced from PubChem (CID 3886490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).