N-[2-[4-(ethylsulfamoyl)phenyl]ethyl]-2-(oxan-2-yl)acetamide

C17H26N2O4S — CID 110624165

IUPACN-[2-[4-(ethylsulfamoyl)phenyl]ethyl]-2-(oxan-2-yl)acetamide
SMILESCCNS(=O)(=O)c1ccc(CCNC(=O)CC2CCCCO2)cc1
InChIInChI=1S/C17H26N2O4S/c1-2-19-24(21,22)16-8-6-14(7-9-16)10-11-18-17(20)13-15-5-3-4-12-23-15/h6-9,15,19H,2-5,10-13H2,1H3,(H,18,20)
InChIKeyULDBVWPCESKJCB-UHFFFAOYSA-N
MW354.47 g/mol
LogP1.60
Rot. Bonds8

About N-[2-[4-(ethylsulfamoyl)phenyl]ethyl]-2-(oxan-2-yl)acetamide

N-[2-[4-(ethylsulfamoyl)phenyl]ethyl]-2-(oxan-2-yl)acetamide (PubChem CID 110624165) has the molecular formula C17H26N2O4S and a molecular weight of 354.47 g/mol. Its IUPAC name is N-[2-[4-(ethylsulfamoyl)phenyl]ethyl]-2-(oxan-2-yl)acetamide.

Molecular Properties

Compound NameN-[2-[4-(ethylsulfamoyl)phenyl]ethyl]-2-(oxan-2-yl)acetamide
PubChem CID110624165
Molecular FormulaC17H26N2O4S
Molecular Weight354.47 g/mol
Exact Mass354.16
IUPAC NameN-[2-[4-(ethylsulfamoyl)phenyl]ethyl]-2-(oxan-2-yl)acetamide
SMILESCCNS(=O)(=O)c1ccc(CCNC(=O)CC2CCCCO2)cc1
InChIInChI=1S/C17H26N2O4S/c1-2-19-24(21,22)16-8-6-14(7-9-16)10-11-18-17(20)13-15-5-3-4-12-23-15/h6-9,15,19H,2-5,10-13H2,1H3,(H,18,20)
InChIKeyULDBVWPCESKJCB-UHFFFAOYSA-N
XLogP1.60
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.47
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[2-[4-(ethylsulfamoyl)phenyl]ethyl]-2-(oxan-2-yl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(ethylsulfamoyl)phenyl]ethyl]-2-(oxan-2-yl)acetamide?
The IUPAC name of N-[2-[4-(ethylsulfamoyl)phenyl]ethyl]-2-(oxan-2-yl)acetamide (CID 110624165) is N-[2-[4-(ethylsulfamoyl)phenyl]ethyl]-2-(oxan-2-yl)acetamide.
What is the SMILES notation for N-[2-[4-(ethylsulfamoyl)phenyl]ethyl]-2-(oxan-2-yl)acetamide?
The canonical SMILES for N-[2-[4-(ethylsulfamoyl)phenyl]ethyl]-2-(oxan-2-yl)acetamide is CCNS(=O)(=O)c1ccc(CCNC(=O)CC2CCCCO2)cc1.
What is the InChIKey of N-[2-[4-(ethylsulfamoyl)phenyl]ethyl]-2-(oxan-2-yl)acetamide?
The InChIKey is ULDBVWPCESKJCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O4S/c1-2-19-24(21,22)16-8-6-14(7-9-16)10-11-18-17(20)13-15-5-3-4-12-23-15/h6-9,15,19H,2-5,10-13H2,1H3,(H,18,20).
What are the key properties of N-[2-[4-(ethylsulfamoyl)phenyl]ethyl]-2-(oxan-2-yl)acetamide?
N-[2-[4-(ethylsulfamoyl)phenyl]ethyl]-2-(oxan-2-yl)acetamide has a molecular weight of 354.47 g/mol, XLogP of 1.60, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(ethylsulfamoyl)phenyl]ethyl]-2-(oxan-2-yl)acetamide is sourced from PubChem (CID 110624165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).