4-(dimethylsulfamoyl)-N-(2-hydroxy-5-methylphenyl)thiophene-2-carboxamide

C14H16N2O4S2 — CID 6503102

IUPAC4-(dimethylsulfamoyl)-N-(2-hydroxy-5-methylphenyl)thiophene-2-carboxamide
SMILESCc1ccc(O)c(NC(=O)c2cc(S(=O)(=O)N(C)C)cs2)c1
InChIInChI=1S/C14H16N2O4S2/c1-9-4-5-12(17)11(6-9)15-14(18)13-7-10(8-21-13)22(19,20)16(2)3/h4-8,17H,1-3H3,(H,15,18)
InChIKeyCKCKAPOPHQQSHA-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.26
Rot. Bonds4

About 4-(dimethylsulfamoyl)-N-(2-hydroxy-5-methylphenyl)thiophene-2-carboxamide

4-(dimethylsulfamoyl)-N-(2-hydroxy-5-methylphenyl)thiophene-2-carboxamide (PubChem CID 6503102) has the molecular formula C14H16N2O4S2 and a molecular weight of 340.43 g/mol. Its IUPAC name is 4-(dimethylsulfamoyl)-N-(2-hydroxy-5-methylphenyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name4-(dimethylsulfamoyl)-N-(2-hydroxy-5-methylphenyl)thiophene-2-carboxamide
PubChem CID6503102
Molecular FormulaC14H16N2O4S2
Molecular Weight340.43 g/mol
Exact Mass340.06
IUPAC Name4-(dimethylsulfamoyl)-N-(2-hydroxy-5-methylphenyl)thiophene-2-carboxamide
SMILESCc1ccc(O)c(NC(=O)c2cc(S(=O)(=O)N(C)C)cs2)c1
InChIInChI=1S/C14H16N2O4S2/c1-9-4-5-12(17)11(6-9)15-14(18)13-7-10(8-21-13)22(19,20)16(2)3/h4-8,17H,1-3H3,(H,15,18)
InChIKeyCKCKAPOPHQQSHA-UHFFFAOYSA-N
XLogP2.26
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

N-(2,4-dimethylphenyl)-4-(dimethylsulfamoyl)thiophene-2-carboxamide
CID 6503076
4-(dimethylsulfamoyl)-N-(2-methylphenyl)thiophene-2-carboxamide
CID 6503064
N-(2-hydroxy-5-methylphenyl)-4-morpholin-4-ylsulfonylthiophene-2-carboxamide
CID 6503499
N-(2,5-dichlorophenyl)-4-(dimethylsulfamoyl)thiophene-2-carboxamide
CID 6503075
4-(dimethylsulfamoyl)-N-(2-methoxyphenyl)thiophene-2-carboxamide
CID 6503057
4-(diethylsulfamoyl)-N-(2-hydroxyphenyl)thiophene-2-carboxamide
CID 6503203
N-(2,4-dimethylphenyl)-4-[2-methoxyethyl(methyl)sulfamoyl]thiophene-2-carboxamide
CID 6503852
4-[methyl-(3-methylphenyl)sulfamoyl]-N-(2-methylphenyl)thiophene-2-carboxamide
CID 6503694
3-[[4-(dimethylsulfamoyl)thiophene-2-carbonyl]amino]benzoic acid
CID 6503094
N-[5-(dimethylsulfamoyl)-2-hydroxyphenyl]-1,5-dimethylpyrrole-2-carboxamide
CID 38339887
N-(2,4-dimethylphenyl)-4-piperidin-1-ylsulfonylthiophene-2-carboxamide
CID 6503249
4-(diethylsulfamoyl)-N-(2-nitrophenyl)thiophene-2-carboxamide
CID 2907877

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylsulfamoyl)-N-(2-hydroxy-5-methylphenyl)thiophene-2-carboxamide?
The IUPAC name of 4-(dimethylsulfamoyl)-N-(2-hydroxy-5-methylphenyl)thiophene-2-carboxamide (CID 6503102) is 4-(dimethylsulfamoyl)-N-(2-hydroxy-5-methylphenyl)thiophene-2-carboxamide.
What is the SMILES notation for 4-(dimethylsulfamoyl)-N-(2-hydroxy-5-methylphenyl)thiophene-2-carboxamide?
The canonical SMILES for 4-(dimethylsulfamoyl)-N-(2-hydroxy-5-methylphenyl)thiophene-2-carboxamide is Cc1ccc(O)c(NC(=O)c2cc(S(=O)(=O)N(C)C)cs2)c1.
What is the InChIKey of 4-(dimethylsulfamoyl)-N-(2-hydroxy-5-methylphenyl)thiophene-2-carboxamide?
The InChIKey is CKCKAPOPHQQSHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O4S2/c1-9-4-5-12(17)11(6-9)15-14(18)13-7-10(8-21-13)22(19,20)16(2)3/h4-8,17H,1-3H3,(H,15,18).
What are the key properties of 4-(dimethylsulfamoyl)-N-(2-hydroxy-5-methylphenyl)thiophene-2-carboxamide?
4-(dimethylsulfamoyl)-N-(2-hydroxy-5-methylphenyl)thiophene-2-carboxamide has a molecular weight of 340.43 g/mol, XLogP of 2.26, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylsulfamoyl)-N-(2-hydroxy-5-methylphenyl)thiophene-2-carboxamide is sourced from PubChem (CID 6503102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).