N-[3-(diethylsulfamoyl)phenyl]-3-(methoxymethyl)benzamide

C19H24N2O4S — CID 8777307

IUPACN-[3-(diethylsulfamoyl)phenyl]-3-(methoxymethyl)benzamide
SMILESCCN(CC)S(=O)(=O)c1cccc(NC(=O)c2cccc(COC)c2)c1
InChIInChI=1S/C19H24N2O4S/c1-4-21(5-2)26(23,24)18-11-7-10-17(13-18)20-19(22)16-9-6-8-15(12-16)14-25-3/h6-13H,4-5,14H2,1-3H3,(H,20,22)
InChIKeyYKVMKPDUBPGKPK-UHFFFAOYSA-N
MW376.48 g/mol
LogP3.12
Rot. Bonds8

About N-[3-(diethylsulfamoyl)phenyl]-3-(methoxymethyl)benzamide

N-[3-(diethylsulfamoyl)phenyl]-3-(methoxymethyl)benzamide (PubChem CID 8777307) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is N-[3-(diethylsulfamoyl)phenyl]-3-(methoxymethyl)benzamide.

Molecular Properties

Compound NameN-[3-(diethylsulfamoyl)phenyl]-3-(methoxymethyl)benzamide
PubChem CID8777307
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC NameN-[3-(diethylsulfamoyl)phenyl]-3-(methoxymethyl)benzamide
SMILESCCN(CC)S(=O)(=O)c1cccc(NC(=O)c2cccc(COC)c2)c1
InChIInChI=1S/C19H24N2O4S/c1-4-21(5-2)26(23,24)18-11-7-10-17(13-18)20-19(22)16-9-6-8-15(12-16)14-25-3/h6-13H,4-5,14H2,1-3H3,(H,20,22)
InChIKeyYKVMKPDUBPGKPK-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]-3-(methoxymethyl)benzamide?
The IUPAC name of N-[3-(diethylsulfamoyl)phenyl]-3-(methoxymethyl)benzamide (CID 8777307) is N-[3-(diethylsulfamoyl)phenyl]-3-(methoxymethyl)benzamide.
What is the SMILES notation for N-[3-(diethylsulfamoyl)phenyl]-3-(methoxymethyl)benzamide?
The canonical SMILES for N-[3-(diethylsulfamoyl)phenyl]-3-(methoxymethyl)benzamide is CCN(CC)S(=O)(=O)c1cccc(NC(=O)c2cccc(COC)c2)c1.
What is the InChIKey of N-[3-(diethylsulfamoyl)phenyl]-3-(methoxymethyl)benzamide?
The InChIKey is YKVMKPDUBPGKPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-4-21(5-2)26(23,24)18-11-7-10-17(13-18)20-19(22)16-9-6-8-15(12-16)14-25-3/h6-13H,4-5,14H2,1-3H3,(H,20,22).
What are the key properties of N-[3-(diethylsulfamoyl)phenyl]-3-(methoxymethyl)benzamide?
N-[3-(diethylsulfamoyl)phenyl]-3-(methoxymethyl)benzamide 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]-3-(methoxymethyl)benzamide is sourced from PubChem (CID 8777307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).