N-cyclopentyl-3-[4-(ethylsulfamoyl)phenyl]propanamide

C16H24N2O3S — CID 2222560

IUPACN-cyclopentyl-3-[4-(ethylsulfamoyl)phenyl]propanamide
SMILESCCNS(=O)(=O)c1ccc(CCC(=O)NC2CCCC2)cc1
InChIInChI=1S/C16H24N2O3S/c1-2-17-22(20,21)15-10-7-13(8-11-15)9-12-16(19)18-14-5-3-4-6-14/h7-8,10-11,14,17H,2-6,9,12H2,1H3,(H,18,19)
InChIKeyYVJYPBAARNRBJN-UHFFFAOYSA-N
MW324.45 g/mol
LogP1.98
Rot. Bonds7

About N-cyclopentyl-3-[4-(ethylsulfamoyl)phenyl]propanamide

N-cyclopentyl-3-[4-(ethylsulfamoyl)phenyl]propanamide (PubChem CID 2222560) has the molecular formula C16H24N2O3S and a molecular weight of 324.45 g/mol. Its IUPAC name is N-cyclopentyl-3-[4-(ethylsulfamoyl)phenyl]propanamide.

Molecular Properties

Compound NameN-cyclopentyl-3-[4-(ethylsulfamoyl)phenyl]propanamide
PubChem CID2222560
Molecular FormulaC16H24N2O3S
Molecular Weight324.45 g/mol
Exact Mass324.15
IUPAC NameN-cyclopentyl-3-[4-(ethylsulfamoyl)phenyl]propanamide
SMILESCCNS(=O)(=O)c1ccc(CCC(=O)NC2CCCC2)cc1
InChIInChI=1S/C16H24N2O3S/c1-2-17-22(20,21)15-10-7-13(8-11-15)9-12-16(19)18-14-5-3-4-6-14/h7-8,10-11,14,17H,2-6,9,12H2,1H3,(H,18,19)
InChIKeyYVJYPBAARNRBJN-UHFFFAOYSA-N
XLogP1.98
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.45
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3-[4-(ethylsulfamoyl)phenyl]propanamide?
The IUPAC name of N-cyclopentyl-3-[4-(ethylsulfamoyl)phenyl]propanamide (CID 2222560) is N-cyclopentyl-3-[4-(ethylsulfamoyl)phenyl]propanamide.
What is the SMILES notation for N-cyclopentyl-3-[4-(ethylsulfamoyl)phenyl]propanamide?
The canonical SMILES for N-cyclopentyl-3-[4-(ethylsulfamoyl)phenyl]propanamide is CCNS(=O)(=O)c1ccc(CCC(=O)NC2CCCC2)cc1.
What is the InChIKey of N-cyclopentyl-3-[4-(ethylsulfamoyl)phenyl]propanamide?
The InChIKey is YVJYPBAARNRBJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3S/c1-2-17-22(20,21)15-10-7-13(8-11-15)9-12-16(19)18-14-5-3-4-6-14/h7-8,10-11,14,17H,2-6,9,12H2,1H3,(H,18,19).
What are the key properties of N-cyclopentyl-3-[4-(ethylsulfamoyl)phenyl]propanamide?
N-cyclopentyl-3-[4-(ethylsulfamoyl)phenyl]propanamide has a molecular weight of 324.45 g/mol, XLogP of 1.98, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3-[4-(ethylsulfamoyl)phenyl]propanamide is sourced from PubChem (CID 2222560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).