N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-4-methoxybenzamide

C20H26N2O4S — CID 51151516

IUPACN-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-4-methoxybenzamide
SMILESCCN(CC)S(=O)(=O)c1ccc(C(C)NC(=O)c2ccc(OC)cc2)cc1
InChIInChI=1S/C20H26N2O4S/c1-5-22(6-2)27(24,25)19-13-9-16(10-14-19)15(3)21-20(23)17-7-11-18(26-4)12-8-17/h7-15H,5-6H2,1-4H3,(H,21,23)
InChIKeyXERAIDLLCCJEID-UHFFFAOYSA-N
MW390.51 g/mol
LogP3.22
Rot. Bonds8

About N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-4-methoxybenzamide

N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-4-methoxybenzamide (PubChem CID 51151516) has the molecular formula C20H26N2O4S and a molecular weight of 390.51 g/mol. Its IUPAC name is N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-4-methoxybenzamide.

Molecular Properties

Compound NameN-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-4-methoxybenzamide
PubChem CID51151516
Molecular FormulaC20H26N2O4S
Molecular Weight390.51 g/mol
Exact Mass390.16
IUPAC NameN-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-4-methoxybenzamide
SMILESCCN(CC)S(=O)(=O)c1ccc(C(C)NC(=O)c2ccc(OC)cc2)cc1
InChIInChI=1S/C20H26N2O4S/c1-5-22(6-2)27(24,25)19-13-9-16(10-14-19)15(3)21-20(23)17-7-11-18(26-4)12-8-17/h7-15H,5-6H2,1-4H3,(H,21,23)
InChIKeyXERAIDLLCCJEID-UHFFFAOYSA-N
XLogP3.22
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.51
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(diethylsulfamoyl)-N-[(1S)-1-(4-methoxyphenyl)-2-methylpropyl]benzamide
CID 9048652
N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-4-iodobenzamide
CID 55339070
N-[(1R)-1-(4-methoxyphenyl)ethyl]-4-[(4-methoxyphenyl)sulfonyl-methylamino]benzamide
CID 92685580
1-N,4-N-bis[(1S)-1-(4-methoxyphenyl)ethyl]benzene-1,4-dicarboxamide
CID 2211003
4-[ethyl-(4-methylsulfanylphenyl)sulfonylamino]-N-[(1S)-1-(4-methoxyphenyl)ethyl]benzamide
CID 94013014
(E)-N-[(1R)-1-[4-(diethylsulfamoyl)phenyl]ethyl]-3-(4-methoxyphenyl)prop-2-enamide
CID 9246720
2-[ethyl-(4-methylphenyl)sulfonylamino]-N-[(1S)-1-(4-methoxyphenyl)ethyl]acetamide
CID 28547067
N-[(1R)-1-(4-chlorophenyl)ethyl]-2-[ethyl-(4-methoxyphenyl)sulfonylamino]acetamide
CID 125044817
N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-3-methoxy-4-prop-2-enoxybenzamide
CID 55454405
N-[(1S)-1-(4-ethoxyphenyl)ethyl]-4-methoxybenzamide
CID 880654
N-[1-(4-methoxyphenyl)ethyl]-4-[(4-methoxyphenyl)sulfonylamino]benzamide
CID 132672025
4-(ethylsulfonylamino)-N-[(1S)-1-(4-methoxyphenyl)ethyl]benzamide
CID 94027949

Frequently Asked Questions

What is the IUPAC name of N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-4-methoxybenzamide?
The IUPAC name of N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-4-methoxybenzamide (CID 51151516) is N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-4-methoxybenzamide.
What is the SMILES notation for N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-4-methoxybenzamide?
The canonical SMILES for N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-4-methoxybenzamide is CCN(CC)S(=O)(=O)c1ccc(C(C)NC(=O)c2ccc(OC)cc2)cc1.
What is the InChIKey of N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-4-methoxybenzamide?
The InChIKey is XERAIDLLCCJEID-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O4S/c1-5-22(6-2)27(24,25)19-13-9-16(10-14-19)15(3)21-20(23)17-7-11-18(26-4)12-8-17/h7-15H,5-6H2,1-4H3,(H,21,23).
What are the key properties of N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-4-methoxybenzamide?
N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-4-methoxybenzamide has a molecular weight of 390.51 g/mol, XLogP of 3.22, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-4-methoxybenzamide is sourced from PubChem (CID 51151516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).