4-(diethylsulfamoyl)-N-(thiophen-2-ylmethyl)benzamide

C16H20N2O3S2 — CID 4882047

IUPAC4-(diethylsulfamoyl)-N-(thiophen-2-ylmethyl)benzamide
SMILESCCN(CC)S(=O)(=O)c1ccc(C(=O)NCc2cccs2)cc1
InChIInChI=1S/C16H20N2O3S2/c1-3-18(4-2)23(20,21)15-9-7-13(8-10-15)16(19)17-12-14-6-5-11-22-14/h5-11H,3-4,12H2,1-2H3,(H,17,19)
InChIKeyVOAAWIRVBODZCQ-UHFFFAOYSA-N
MW352.48 g/mol
LogP2.71
Rot. Bonds7

About 4-(diethylsulfamoyl)-N-(thiophen-2-ylmethyl)benzamide

4-(diethylsulfamoyl)-N-(thiophen-2-ylmethyl)benzamide (PubChem CID 4882047) has the molecular formula C16H20N2O3S2 and a molecular weight of 352.48 g/mol. Its IUPAC name is 4-(diethylsulfamoyl)-N-(thiophen-2-ylmethyl)benzamide.

Molecular Properties

Compound Name4-(diethylsulfamoyl)-N-(thiophen-2-ylmethyl)benzamide
PubChem CID4882047
Molecular FormulaC16H20N2O3S2
Molecular Weight352.48 g/mol
Exact Mass352.09
IUPAC Name4-(diethylsulfamoyl)-N-(thiophen-2-ylmethyl)benzamide
SMILESCCN(CC)S(=O)(=O)c1ccc(C(=O)NCc2cccs2)cc1
InChIInChI=1S/C16H20N2O3S2/c1-3-18(4-2)23(20,21)15-9-7-13(8-10-15)16(19)17-12-14-6-5-11-22-14/h5-11H,3-4,12H2,1-2H3,(H,17,19)
InChIKeyVOAAWIRVBODZCQ-UHFFFAOYSA-N
XLogP2.71
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.48
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(diethylsulfamoyl)-1-methyl-N-(thiophen-2-ylmethyl)indole-2-carboxamide
CID 50801937
[2-[methyl(thiophen-2-ylmethyl)amino]-2-oxoethyl] 2-[[4-(diethylsulfamoyl)benzoyl]amino]acetate
CID 55304134
4-(diethylsulfamoyl)-N-(furan-2-ylmethyl)benzamide
CID 2596785
1-[[4-(diethylsulfamoyl)phenyl]methyl]-3-(2-thiophen-2-ylethyl)urea
CID 41249871
4-(diethylsulfamoyl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]benzamide
CID 47728458
4-(diethylsulfamoyl)-N-prop-2-enyl-N-(thiophen-2-ylmethyl)benzamide
CID 78801560
N-[[4-(diethylsulfamoyl)phenyl]methyl]-4-thiophen-2-ylbutanamide
CID 9474553
N-(2-cyclopropyl-2-hydroxy-2-thiophen-2-ylethyl)-4-(diethylsulfamoyl)benzamide
CID 90497084
[2-oxo-2-(thiophene-2-carbonylamino)ethyl] 2-[[4-(diethylsulfamoyl)benzoyl]amino]acetate
CID 55356749
4-(diethylsulfamoyl)-N-[(2-thiophen-3-ylphenyl)methyl]benzamide
CID 121145078
4-(diethylsulfamoyl)-N-(1H-pyrrol-3-ylmethyl)benzamide
CID 110782686
N-[4-[ethyl(thiophen-2-ylmethyl)sulfamoyl]phenyl]acetamide
CID 30171646

Frequently Asked Questions

What is the IUPAC name of 4-(diethylsulfamoyl)-N-(thiophen-2-ylmethyl)benzamide?
The IUPAC name of 4-(diethylsulfamoyl)-N-(thiophen-2-ylmethyl)benzamide (CID 4882047) is 4-(diethylsulfamoyl)-N-(thiophen-2-ylmethyl)benzamide.
What is the SMILES notation for 4-(diethylsulfamoyl)-N-(thiophen-2-ylmethyl)benzamide?
The canonical SMILES for 4-(diethylsulfamoyl)-N-(thiophen-2-ylmethyl)benzamide is CCN(CC)S(=O)(=O)c1ccc(C(=O)NCc2cccs2)cc1.
What is the InChIKey of 4-(diethylsulfamoyl)-N-(thiophen-2-ylmethyl)benzamide?
The InChIKey is VOAAWIRVBODZCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O3S2/c1-3-18(4-2)23(20,21)15-9-7-13(8-10-15)16(19)17-12-14-6-5-11-22-14/h5-11H,3-4,12H2,1-2H3,(H,17,19).
What are the key properties of 4-(diethylsulfamoyl)-N-(thiophen-2-ylmethyl)benzamide?
4-(diethylsulfamoyl)-N-(thiophen-2-ylmethyl)benzamide has a molecular weight of 352.48 g/mol, XLogP of 2.71, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(diethylsulfamoyl)-N-(thiophen-2-ylmethyl)benzamide is sourced from PubChem (CID 4882047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).