2-[4-(cyclopentylsulfamoyl)phenoxy]-N-(2-methylphenyl)acetamide

C20H24N2O4S — CID 45374112

IUPAC2-[4-(cyclopentylsulfamoyl)phenoxy]-N-(2-methylphenyl)acetamide
SMILESCc1ccccc1NC(=O)COc1ccc(S(=O)(=O)NC2CCCC2)cc1
InChIInChI=1S/C20H24N2O4S/c1-15-6-2-5-9-19(15)21-20(23)14-26-17-10-12-18(13-11-17)27(24,25)22-16-7-3-4-8-16/h2,5-6,9-13,16,22H,3-4,7-8,14H2,1H3,(H,21,23)
InChIKeyJKZNWXIJELGXRX-UHFFFAOYSA-N
MW388.49 g/mol
LogP3.23
Rot. Bonds7

About 2-[4-(cyclopentylsulfamoyl)phenoxy]-N-(2-methylphenyl)acetamide

2-[4-(cyclopentylsulfamoyl)phenoxy]-N-(2-methylphenyl)acetamide (PubChem CID 45374112) has the molecular formula C20H24N2O4S and a molecular weight of 388.49 g/mol. Its IUPAC name is 2-[4-(cyclopentylsulfamoyl)phenoxy]-N-(2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[4-(cyclopentylsulfamoyl)phenoxy]-N-(2-methylphenyl)acetamide
PubChem CID45374112
Molecular FormulaC20H24N2O4S
Molecular Weight388.49 g/mol
Exact Mass388.15
IUPAC Name2-[4-(cyclopentylsulfamoyl)phenoxy]-N-(2-methylphenyl)acetamide
SMILESCc1ccccc1NC(=O)COc1ccc(S(=O)(=O)NC2CCCC2)cc1
InChIInChI=1S/C20H24N2O4S/c1-15-6-2-5-9-19(15)21-20(23)14-26-17-10-12-18(13-11-17)27(24,25)22-16-7-3-4-8-16/h2,5-6,9-13,16,22H,3-4,7-8,14H2,1H3,(H,21,23)
InChIKeyJKZNWXIJELGXRX-UHFFFAOYSA-N
XLogP3.23
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.49
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(cyclopentylsulfamoyl)phenoxy]-N-(2-methylphenyl)acetamide?
The IUPAC name of 2-[4-(cyclopentylsulfamoyl)phenoxy]-N-(2-methylphenyl)acetamide (CID 45374112) is 2-[4-(cyclopentylsulfamoyl)phenoxy]-N-(2-methylphenyl)acetamide.
What is the SMILES notation for 2-[4-(cyclopentylsulfamoyl)phenoxy]-N-(2-methylphenyl)acetamide?
The canonical SMILES for 2-[4-(cyclopentylsulfamoyl)phenoxy]-N-(2-methylphenyl)acetamide is Cc1ccccc1NC(=O)COc1ccc(S(=O)(=O)NC2CCCC2)cc1.
What is the InChIKey of 2-[4-(cyclopentylsulfamoyl)phenoxy]-N-(2-methylphenyl)acetamide?
The InChIKey is JKZNWXIJELGXRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4S/c1-15-6-2-5-9-19(15)21-20(23)14-26-17-10-12-18(13-11-17)27(24,25)22-16-7-3-4-8-16/h2,5-6,9-13,16,22H,3-4,7-8,14H2,1H3,(H,21,23).
What are the key properties of 2-[4-(cyclopentylsulfamoyl)phenoxy]-N-(2-methylphenyl)acetamide?
2-[4-(cyclopentylsulfamoyl)phenoxy]-N-(2-methylphenyl)acetamide has a molecular weight of 388.49 g/mol, XLogP of 3.23, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(cyclopentylsulfamoyl)phenoxy]-N-(2-methylphenyl)acetamide is sourced from PubChem (CID 45374112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).