N,N-diethyl-2-(thiophen-2-ylsulfonylamino)benzamide

C15H18N2O3S2 — CID 6461716

IUPACN,N-diethyl-2-(thiophen-2-ylsulfonylamino)benzamide
SMILESCCN(CC)C(=O)c1ccccc1NS(=O)(=O)c1cccs1
InChIInChI=1S/C15H18N2O3S2/c1-3-17(4-2)15(18)12-8-5-6-9-13(12)16-22(19,20)14-10-7-11-21-14/h5-11,16H,3-4H2,1-2H3
InChIKeyWMQPBSZYSXOSBQ-UHFFFAOYSA-N
MW338.45 g/mol
LogP3.03
Rot. Bonds6

About N,N-diethyl-2-(thiophen-2-ylsulfonylamino)benzamide

N,N-diethyl-2-(thiophen-2-ylsulfonylamino)benzamide (PubChem CID 6461716) has the molecular formula C15H18N2O3S2 and a molecular weight of 338.45 g/mol. Its IUPAC name is N,N-diethyl-2-(thiophen-2-ylsulfonylamino)benzamide.

Molecular Properties

Compound NameN,N-diethyl-2-(thiophen-2-ylsulfonylamino)benzamide
PubChem CID6461716
Molecular FormulaC15H18N2O3S2
Molecular Weight338.45 g/mol
Exact Mass338.08
IUPAC NameN,N-diethyl-2-(thiophen-2-ylsulfonylamino)benzamide
SMILESCCN(CC)C(=O)c1ccccc1NS(=O)(=O)c1cccs1
InChIInChI=1S/C15H18N2O3S2/c1-3-17(4-2)15(18)12-8-5-6-9-13(12)16-22(19,20)14-10-7-11-21-14/h5-11,16H,3-4H2,1-2H3
InChIKeyWMQPBSZYSXOSBQ-UHFFFAOYSA-N
XLogP3.03
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.45
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(benzenesulfonamido)-N-(thiolan-3-yl)benzamide
CID 2805665
N-[2-(piperidine-1-carbonyl)phenyl]thiophene-2-carboxamide
CID 827614
2-[(methylsulfonyl)amino]-N-[2-(phenylthio)ethyl]benzamide
CID 2234045
N-[(4-sulfamoylphenyl)methyl]-4-(thiophen-2-ylsulfonylamino)benzamide
CID 2527187
N-[5-(dimethylsulfamoyl)-2-methylphenyl]thiophene-2-carboxamide
CID 2811895
N-methyl-N-[4-(piperidine-1-carbonyl)phenyl]thiophene-2-sulfonamide
CID 2989171
4-[ethyl(phenyl)sulfamoyl]-N-methyl-N-(thiophen-2-ylmethyl)benzamide
CID 4963703
4-{[Methyl(3-methylphenyl)amino]sulfonyl}thiophene-2-carboxamide
CID 6486034
4-{[(2-Methylphenyl)amino]sulfonyl}thiophene-2-carboxamide
CID 8028190
N-[2-(4-methylpiperazine-1-carbonyl)phenyl]thiophene-2-carboxamide
CID 724147
N,N-diethyl-2-{[(4-methylphenyl)sulfonyl]amino}benzamide
CID 1266725
2-[(Thiophen-2-ylacetyl)amino]benzamide
CID 1147556

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-(thiophen-2-ylsulfonylamino)benzamide?
The IUPAC name of N,N-diethyl-2-(thiophen-2-ylsulfonylamino)benzamide (CID 6461716) is N,N-diethyl-2-(thiophen-2-ylsulfonylamino)benzamide.
What is the SMILES notation for N,N-diethyl-2-(thiophen-2-ylsulfonylamino)benzamide?
The canonical SMILES for N,N-diethyl-2-(thiophen-2-ylsulfonylamino)benzamide is CCN(CC)C(=O)c1ccccc1NS(=O)(=O)c1cccs1.
What is the InChIKey of N,N-diethyl-2-(thiophen-2-ylsulfonylamino)benzamide?
The InChIKey is WMQPBSZYSXOSBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3S2/c1-3-17(4-2)15(18)12-8-5-6-9-13(12)16-22(19,20)14-10-7-11-21-14/h5-11,16H,3-4H2,1-2H3.
What are the key properties of N,N-diethyl-2-(thiophen-2-ylsulfonylamino)benzamide?
N,N-diethyl-2-(thiophen-2-ylsulfonylamino)benzamide has a molecular weight of 338.45 g/mol, XLogP of 3.03, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-(thiophen-2-ylsulfonylamino)benzamide is sourced from PubChem (CID 6461716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).