N-[4-(dibutylsulfamoyl)phenyl]thiophene-2-carboxamide

C19H26N2O3S2 — CID 2186090

IUPACN-[4-(dibutylsulfamoyl)phenyl]thiophene-2-carboxamide
SMILESCCCCN(CCCC)S(=O)(=O)c1ccc(NC(=O)c2cccs2)cc1
InChIInChI=1S/C19H26N2O3S2/c1-3-5-13-21(14-6-4-2)26(23,24)17-11-9-16(10-12-17)20-19(22)18-8-7-15-25-18/h7-12,15H,3-6,13-14H2,1-2H3,(H,20,22)
InChIKeySSXZTEZNFIZHDX-UHFFFAOYSA-N
MW394.56 g/mol
LogP4.59
Rot. Bonds10

About N-[4-(dibutylsulfamoyl)phenyl]thiophene-2-carboxamide

N-[4-(dibutylsulfamoyl)phenyl]thiophene-2-carboxamide (PubChem CID 2186090) has the molecular formula C19H26N2O3S2 and a molecular weight of 394.56 g/mol. Its IUPAC name is N-[4-(dibutylsulfamoyl)phenyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[4-(dibutylsulfamoyl)phenyl]thiophene-2-carboxamide
PubChem CID2186090
Molecular FormulaC19H26N2O3S2
Molecular Weight394.56 g/mol
Exact Mass394.14
IUPAC NameN-[4-(dibutylsulfamoyl)phenyl]thiophene-2-carboxamide
SMILESCCCCN(CCCC)S(=O)(=O)c1ccc(NC(=O)c2cccs2)cc1
InChIInChI=1S/C19H26N2O3S2/c1-3-5-13-21(14-6-4-2)26(23,24)17-11-9-16(10-12-17)20-19(22)18-8-7-15-25-18/h7-12,15H,3-6,13-14H2,1-2H3,(H,20,22)
InChIKeySSXZTEZNFIZHDX-UHFFFAOYSA-N
XLogP4.59
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.56
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-aminophenyl)thiophene-2-carboxamide
CID 736373
N-(4-sulfamoylphenyl)-2-(thiophen-2-yl)acetamide
CID 670143
N,N'-1,4-Phenylenebis[2-thiophenecarboxamide]
CID 573445
N-(4-sulfamoylphenyl)thiophene-2-carboxamide
CID 687455
N-(2-Fluoro-4-Sulfamoylphenyl)-2-(Thiophen-2-Yl)acetamide
CID 44520897
4-[[(E)-3-oxo-3-thiophen-2-ylprop-1-enyl]amino]benzenesulfonamide
CID 2258220
3-[[(E)-3-oxo-3-thiophen-2-ylprop-1-enyl]amino]benzenesulfonamide
CID 168286735
5-methyl-N-[4-(methylsulfamoyl)phenyl]thiophene-3-carboxamide
CID 1247495
N-[(4-sulfamoylphenyl)carbamothioyl]thiophene-2-carboxamide
CID 1828675
N-[4-(butylsulfamoyl)phenyl]thiophene-2-carboxamide
CID 2188561
N-[5-(dimethylsulfamoyl)-2-methylphenyl]thiophene-2-carboxamide
CID 2811895
3-amino-N-(4-fluorophenyl)-4-(isopropylsulfonyl)-2-thiophenecarboxamide
CID 2815721

Frequently Asked Questions

What is the IUPAC name of N-[4-(dibutylsulfamoyl)phenyl]thiophene-2-carboxamide?
The IUPAC name of N-[4-(dibutylsulfamoyl)phenyl]thiophene-2-carboxamide (CID 2186090) is N-[4-(dibutylsulfamoyl)phenyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[4-(dibutylsulfamoyl)phenyl]thiophene-2-carboxamide?
The canonical SMILES for N-[4-(dibutylsulfamoyl)phenyl]thiophene-2-carboxamide is CCCCN(CCCC)S(=O)(=O)c1ccc(NC(=O)c2cccs2)cc1.
What is the InChIKey of N-[4-(dibutylsulfamoyl)phenyl]thiophene-2-carboxamide?
The InChIKey is SSXZTEZNFIZHDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O3S2/c1-3-5-13-21(14-6-4-2)26(23,24)17-11-9-16(10-12-17)20-19(22)18-8-7-15-25-18/h7-12,15H,3-6,13-14H2,1-2H3,(H,20,22).
What are the key properties of N-[4-(dibutylsulfamoyl)phenyl]thiophene-2-carboxamide?
N-[4-(dibutylsulfamoyl)phenyl]thiophene-2-carboxamide has a molecular weight of 394.56 g/mol, XLogP of 4.59, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(dibutylsulfamoyl)phenyl]thiophene-2-carboxamide is sourced from PubChem (CID 2186090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).