2-[4-(cyclohexylsulfamoyl)phenoxy]-N-cyclopentylacetamide

C19H28N2O4S — CID 1005556

IUPAC2-[4-(cyclohexylsulfamoyl)phenoxy]-N-cyclopentylacetamide
SMILESO=C(COc1ccc(S(=O)(=O)NC2CCCCC2)cc1)NC1CCCC1
InChIInChI=1S/C19H28N2O4S/c22-19(20-15-6-4-5-7-15)14-25-17-10-12-18(13-11-17)26(23,24)21-16-8-2-1-3-9-16/h10-13,15-16,21H,1-9,14H2,(H,20,22)
InChIKeyBUNFBQGOHLPLSR-UHFFFAOYSA-N
MW380.51 g/mol
LogP2.74
Rot. Bonds7

About 2-[4-(cyclohexylsulfamoyl)phenoxy]-N-cyclopentylacetamide

2-[4-(cyclohexylsulfamoyl)phenoxy]-N-cyclopentylacetamide (PubChem CID 1005556) has the molecular formula C19H28N2O4S and a molecular weight of 380.51 g/mol. Its IUPAC name is 2-[4-(cyclohexylsulfamoyl)phenoxy]-N-cyclopentylacetamide.

Molecular Properties

Compound Name2-[4-(cyclohexylsulfamoyl)phenoxy]-N-cyclopentylacetamide
PubChem CID1005556
Molecular FormulaC19H28N2O4S
Molecular Weight380.51 g/mol
Exact Mass380.18
IUPAC Name2-[4-(cyclohexylsulfamoyl)phenoxy]-N-cyclopentylacetamide
SMILESO=C(COc1ccc(S(=O)(=O)NC2CCCCC2)cc1)NC1CCCC1
InChIInChI=1S/C19H28N2O4S/c22-19(20-15-6-4-5-7-15)14-25-17-10-12-18(13-11-17)26(23,24)21-16-8-2-1-3-9-16/h10-13,15-16,21H,1-9,14H2,(H,20,22)
InChIKeyBUNFBQGOHLPLSR-UHFFFAOYSA-N
XLogP2.74
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.51
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(cyclohexylsulfamoyl)phenoxy]-N-cyclopentylacetamide?
The IUPAC name of 2-[4-(cyclohexylsulfamoyl)phenoxy]-N-cyclopentylacetamide (CID 1005556) is 2-[4-(cyclohexylsulfamoyl)phenoxy]-N-cyclopentylacetamide.
What is the SMILES notation for 2-[4-(cyclohexylsulfamoyl)phenoxy]-N-cyclopentylacetamide?
The canonical SMILES for 2-[4-(cyclohexylsulfamoyl)phenoxy]-N-cyclopentylacetamide is O=C(COc1ccc(S(=O)(=O)NC2CCCCC2)cc1)NC1CCCC1.
What is the InChIKey of 2-[4-(cyclohexylsulfamoyl)phenoxy]-N-cyclopentylacetamide?
The InChIKey is BUNFBQGOHLPLSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O4S/c22-19(20-15-6-4-5-7-15)14-25-17-10-12-18(13-11-17)26(23,24)21-16-8-2-1-3-9-16/h10-13,15-16,21H,1-9,14H2,(H,20,22).
What are the key properties of 2-[4-(cyclohexylsulfamoyl)phenoxy]-N-cyclopentylacetamide?
2-[4-(cyclohexylsulfamoyl)phenoxy]-N-cyclopentylacetamide has a molecular weight of 380.51 g/mol, XLogP of 2.74, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(cyclohexylsulfamoyl)phenoxy]-N-cyclopentylacetamide is sourced from PubChem (CID 1005556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).