N-[3-(diethylsulfamoyl)phenyl]-2-phenoxypropanamide

C19H24N2O4S — CID 18170408

IUPACN-[3-(diethylsulfamoyl)phenyl]-2-phenoxypropanamide
SMILESCCN(CC)S(=O)(=O)c1cccc(NC(=O)C(C)Oc2ccccc2)c1
InChIInChI=1S/C19H24N2O4S/c1-4-21(5-2)26(23,24)18-13-9-10-16(14-18)20-19(22)15(3)25-17-11-7-6-8-12-17/h6-15H,4-5H2,1-3H3,(H,20,22)
InChIKeyHCWIBXOYGWXLTL-UHFFFAOYSA-N
MW376.48 g/mol
LogP3.12
Rot. Bonds8

About N-[3-(diethylsulfamoyl)phenyl]-2-phenoxypropanamide

N-[3-(diethylsulfamoyl)phenyl]-2-phenoxypropanamide (PubChem CID 18170408) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is N-[3-(diethylsulfamoyl)phenyl]-2-phenoxypropanamide.

Molecular Properties

Compound NameN-[3-(diethylsulfamoyl)phenyl]-2-phenoxypropanamide
PubChem CID18170408
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC NameN-[3-(diethylsulfamoyl)phenyl]-2-phenoxypropanamide
SMILESCCN(CC)S(=O)(=O)c1cccc(NC(=O)C(C)Oc2ccccc2)c1
InChIInChI=1S/C19H24N2O4S/c1-4-21(5-2)26(23,24)18-13-9-10-16(14-18)20-19(22)15(3)25-17-11-7-6-8-12-17/h6-15H,4-5H2,1-3H3,(H,20,22)
InChIKeyHCWIBXOYGWXLTL-UHFFFAOYSA-N
XLogP3.12
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.48
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[3-(diethylsulfamoyl)phenyl]-2-phenoxypropanamide?
The IUPAC name of N-[3-(diethylsulfamoyl)phenyl]-2-phenoxypropanamide (CID 18170408) is N-[3-(diethylsulfamoyl)phenyl]-2-phenoxypropanamide.
What is the SMILES notation for N-[3-(diethylsulfamoyl)phenyl]-2-phenoxypropanamide?
The canonical SMILES for N-[3-(diethylsulfamoyl)phenyl]-2-phenoxypropanamide is CCN(CC)S(=O)(=O)c1cccc(NC(=O)C(C)Oc2ccccc2)c1.
What is the InChIKey of N-[3-(diethylsulfamoyl)phenyl]-2-phenoxypropanamide?
The InChIKey is HCWIBXOYGWXLTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-4-21(5-2)26(23,24)18-13-9-10-16(14-18)20-19(22)15(3)25-17-11-7-6-8-12-17/h6-15H,4-5H2,1-3H3,(H,20,22).
What are the key properties of N-[3-(diethylsulfamoyl)phenyl]-2-phenoxypropanamide?
N-[3-(diethylsulfamoyl)phenyl]-2-phenoxypropanamide has a molecular weight of 376.48 g/mol, XLogP of 3.12, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(diethylsulfamoyl)phenyl]-2-phenoxypropanamide is sourced from PubChem (CID 18170408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).