2-[4-(cyclopentylsulfamoyl)phenoxy]-N,N-diethylacetamide

C17H26N2O4S — CID 45374145

IUPAC2-[4-(cyclopentylsulfamoyl)phenoxy]-N,N-diethylacetamide
SMILESCCN(CC)C(=O)COc1ccc(S(=O)(=O)NC2CCCC2)cc1
InChIInChI=1S/C17H26N2O4S/c1-3-19(4-2)17(20)13-23-15-9-11-16(12-10-15)24(21,22)18-14-7-5-6-8-14/h9-12,14,18H,3-8,13H2,1-2H3
InChIKeySOXFUSCHNBDHMD-UHFFFAOYSA-N
MW354.47 g/mol
LogP2.15
Rot. Bonds8

About 2-[4-(cyclopentylsulfamoyl)phenoxy]-N,N-diethylacetamide

2-[4-(cyclopentylsulfamoyl)phenoxy]-N,N-diethylacetamide (PubChem CID 45374145) has the molecular formula C17H26N2O4S and a molecular weight of 354.47 g/mol. Its IUPAC name is 2-[4-(cyclopentylsulfamoyl)phenoxy]-N,N-diethylacetamide.

Molecular Properties

Compound Name2-[4-(cyclopentylsulfamoyl)phenoxy]-N,N-diethylacetamide
PubChem CID45374145
Molecular FormulaC17H26N2O4S
Molecular Weight354.47 g/mol
Exact Mass354.16
IUPAC Name2-[4-(cyclopentylsulfamoyl)phenoxy]-N,N-diethylacetamide
SMILESCCN(CC)C(=O)COc1ccc(S(=O)(=O)NC2CCCC2)cc1
InChIInChI=1S/C17H26N2O4S/c1-3-19(4-2)17(20)13-23-15-9-11-16(12-10-15)24(21,22)18-14-7-5-6-8-14/h9-12,14,18H,3-8,13H2,1-2H3
InChIKeySOXFUSCHNBDHMD-UHFFFAOYSA-N
XLogP2.15
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.47
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(cyclopentylsulfamoyl)phenoxy]-N-methylacetamide
CID 45375238
N,N-diethyl-2-[4-(propylsulfamoyl)phenoxy]acetamide
CID 45375378
2-[4-(butan-2-ylsulfamoyl)phenoxy]-N,N-diethylacetamide
CID 171317631
2-[4-(cyclopentylsulfamoyl)phenoxy]-N-pentylacetamide
CID 45375351
N-butyl-2-[4-(cyclohexylsulfamoyl)phenoxy]acetamide
CID 45374355
ethyl 4-[[2-[4-(cyclohexylsulfamoyl)phenoxy]acetyl]amino]benzoate
CID 2943450
N-cyclohexyl-4-[2-(4-methylpiperidin-1-yl)-2-oxoethoxy]benzenesulfonamide
CID 1084693
2-[4-(cyclopentylsulfamoyl)phenoxy]-N-(2-methylphenyl)acetamide
CID 45374112
2-[4-[[(4Z)-cyclooct-4-en-1-yl]sulfamoyl]phenoxy]acetic acid
CID 166258390
methyl 4-[[2-[4-(cyclohexylsulfamoyl)phenoxy]acetyl]amino]benzoate
CID 45374668
2-[4-(cyclohexylsulfamoyl)phenoxy]-N-(2-methylphenyl)acetamide
CID 1317115
2-[4-(cyclopentylsulfamoyl)phenoxy]-N-[2-(4-methoxyphenyl)ethyl]acetamide
CID 45374111

Frequently Asked Questions

What is the IUPAC name of 2-[4-(cyclopentylsulfamoyl)phenoxy]-N,N-diethylacetamide?
The IUPAC name of 2-[4-(cyclopentylsulfamoyl)phenoxy]-N,N-diethylacetamide (CID 45374145) is 2-[4-(cyclopentylsulfamoyl)phenoxy]-N,N-diethylacetamide.
What is the SMILES notation for 2-[4-(cyclopentylsulfamoyl)phenoxy]-N,N-diethylacetamide?
The canonical SMILES for 2-[4-(cyclopentylsulfamoyl)phenoxy]-N,N-diethylacetamide is CCN(CC)C(=O)COc1ccc(S(=O)(=O)NC2CCCC2)cc1.
What is the InChIKey of 2-[4-(cyclopentylsulfamoyl)phenoxy]-N,N-diethylacetamide?
The InChIKey is SOXFUSCHNBDHMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O4S/c1-3-19(4-2)17(20)13-23-15-9-11-16(12-10-15)24(21,22)18-14-7-5-6-8-14/h9-12,14,18H,3-8,13H2,1-2H3.
What are the key properties of 2-[4-(cyclopentylsulfamoyl)phenoxy]-N,N-diethylacetamide?
2-[4-(cyclopentylsulfamoyl)phenoxy]-N,N-diethylacetamide has a molecular weight of 354.47 g/mol, XLogP of 2.15, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(cyclopentylsulfamoyl)phenoxy]-N,N-diethylacetamide is sourced from PubChem (CID 45374145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).