N-[3-(dimethylsulfamoyl)phenyl]-2-naphthalen-1-yloxyacetamide

C20H20N2O4S — CID 3917864

IUPACN-[3-(dimethylsulfamoyl)phenyl]-2-naphthalen-1-yloxyacetamide
SMILESCN(C)S(=O)(=O)c1cccc(NC(=O)COc2cccc3ccccc23)c1
InChIInChI=1S/C20H20N2O4S/c1-22(2)27(24,25)17-10-6-9-16(13-17)21-20(23)14-26-19-12-5-8-15-7-3-4-11-18(15)19/h3-13H,14H2,1-2H3,(H,21,23)
InChIKeyPIEFFWINOYREBD-UHFFFAOYSA-N
MW384.46 g/mol
LogP3.11
Rot. Bonds6

About N-[3-(dimethylsulfamoyl)phenyl]-2-naphthalen-1-yloxyacetamide

N-[3-(dimethylsulfamoyl)phenyl]-2-naphthalen-1-yloxyacetamide (PubChem CID 3917864) has the molecular formula C20H20N2O4S and a molecular weight of 384.46 g/mol. Its IUPAC name is N-[3-(dimethylsulfamoyl)phenyl]-2-naphthalen-1-yloxyacetamide.

Molecular Properties

Compound NameN-[3-(dimethylsulfamoyl)phenyl]-2-naphthalen-1-yloxyacetamide
PubChem CID3917864
Molecular FormulaC20H20N2O4S
Molecular Weight384.46 g/mol
Exact Mass384.11
IUPAC NameN-[3-(dimethylsulfamoyl)phenyl]-2-naphthalen-1-yloxyacetamide
SMILESCN(C)S(=O)(=O)c1cccc(NC(=O)COc2cccc3ccccc23)c1
InChIInChI=1S/C20H20N2O4S/c1-22(2)27(24,25)17-10-6-9-16(13-17)21-20(23)14-26-19-12-5-8-15-7-3-4-11-18(15)19/h3-13H,14H2,1-2H3,(H,21,23)
InChIKeyPIEFFWINOYREBD-UHFFFAOYSA-N
XLogP3.11
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.46
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylsulfamoyl)phenyl]-2-naphthalen-1-yloxyacetamide?
The IUPAC name of N-[3-(dimethylsulfamoyl)phenyl]-2-naphthalen-1-yloxyacetamide (CID 3917864) is N-[3-(dimethylsulfamoyl)phenyl]-2-naphthalen-1-yloxyacetamide.
What is the SMILES notation for N-[3-(dimethylsulfamoyl)phenyl]-2-naphthalen-1-yloxyacetamide?
The canonical SMILES for N-[3-(dimethylsulfamoyl)phenyl]-2-naphthalen-1-yloxyacetamide is CN(C)S(=O)(=O)c1cccc(NC(=O)COc2cccc3ccccc23)c1.
What is the InChIKey of N-[3-(dimethylsulfamoyl)phenyl]-2-naphthalen-1-yloxyacetamide?
The InChIKey is PIEFFWINOYREBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O4S/c1-22(2)27(24,25)17-10-6-9-16(13-17)21-20(23)14-26-19-12-5-8-15-7-3-4-11-18(15)19/h3-13H,14H2,1-2H3,(H,21,23).
What are the key properties of N-[3-(dimethylsulfamoyl)phenyl]-2-naphthalen-1-yloxyacetamide?
N-[3-(dimethylsulfamoyl)phenyl]-2-naphthalen-1-yloxyacetamide has a molecular weight of 384.46 g/mol, XLogP of 3.11, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylsulfamoyl)phenyl]-2-naphthalen-1-yloxyacetamide is sourced from PubChem (CID 3917864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).