4-[ethyl(methyl)sulfamoyl]-N-(3-fluorophenyl)thiophene-2-carboxamide

C14H15FN2O3S2 — CID 6503172

IUPAC4-[ethyl(methyl)sulfamoyl]-N-(3-fluorophenyl)thiophene-2-carboxamide
SMILESCCN(C)S(=O)(=O)c1csc(C(=O)Nc2cccc(F)c2)c1
InChIInChI=1S/C14H15FN2O3S2/c1-3-17(2)22(19,20)12-8-13(21-9-12)14(18)16-11-6-4-5-10(15)7-11/h4-9H,3H2,1-2H3,(H,16,18)
InChIKeyCKMITBUOFZHMTB-UHFFFAOYSA-N
MW342.42 g/mol
LogP2.78
Rot. Bonds5

About 4-[ethyl(methyl)sulfamoyl]-N-(3-fluorophenyl)thiophene-2-carboxamide

4-[ethyl(methyl)sulfamoyl]-N-(3-fluorophenyl)thiophene-2-carboxamide (PubChem CID 6503172) has the molecular formula C14H15FN2O3S2 and a molecular weight of 342.42 g/mol. Its IUPAC name is 4-[ethyl(methyl)sulfamoyl]-N-(3-fluorophenyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name4-[ethyl(methyl)sulfamoyl]-N-(3-fluorophenyl)thiophene-2-carboxamide
PubChem CID6503172
Molecular FormulaC14H15FN2O3S2
Molecular Weight342.42 g/mol
Exact Mass342.05
IUPAC Name4-[ethyl(methyl)sulfamoyl]-N-(3-fluorophenyl)thiophene-2-carboxamide
SMILESCCN(C)S(=O)(=O)c1csc(C(=O)Nc2cccc(F)c2)c1
InChIInChI=1S/C14H15FN2O3S2/c1-3-17(2)22(19,20)12-8-13(21-9-12)14(18)16-11-6-4-5-10(15)7-11/h4-9H,3H2,1-2H3,(H,16,18)
InChIKeyCKMITBUOFZHMTB-UHFFFAOYSA-N
XLogP2.78
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.42
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[ethyl(methyl)sulfamoyl]-N-[3-(trifluoromethyl)phenyl]thiophene-2-carboxamide
CID 6503155
ethyl 4-[[4-[ethyl(methyl)sulfamoyl]thiophene-2-carbonyl]amino]benzoate
CID 6503175
4-(diethylsulfamoyl)-N-[3-(trifluoromethyl)phenyl]thiophene-2-carboxamide
CID 6503209
3-[[4-(dimethylsulfamoyl)thiophene-2-carbonyl]amino]benzoic acid
CID 6503094
4-[ethyl(methyl)sulfamoyl]thiophene-2-carboxylic acid
CID 16761948
4-[(3-fluorophenyl)sulfamoyl]-N-methylthiophene-2-carboxamide
CID 6503928
N-(4-acetylphenyl)-4-(diethylsulfamoyl)thiophene-2-carboxamide
CID 6503218
4-[benzyl(methyl)sulfamoyl]-N-(3-fluorophenyl)benzamide
CID 23885342
N-[3-(diethylsulfamoyl)phenyl]-3-fluorobenzamide
CID 4800184
4-(diethylsulfamoyl)-N-(2-hydroxyphenyl)thiophene-2-carboxamide
CID 6503203
1-ethyl-3-(3-fluorophenyl)-1-methylurea
CID 115603508
N-(3-fluorophenyl)-4-[(4-fluorophenyl)sulfonyl-methylamino]butanamide
CID 30845467

Frequently Asked Questions

What is the IUPAC name of 4-[ethyl(methyl)sulfamoyl]-N-(3-fluorophenyl)thiophene-2-carboxamide?
The IUPAC name of 4-[ethyl(methyl)sulfamoyl]-N-(3-fluorophenyl)thiophene-2-carboxamide (CID 6503172) is 4-[ethyl(methyl)sulfamoyl]-N-(3-fluorophenyl)thiophene-2-carboxamide.
What is the SMILES notation for 4-[ethyl(methyl)sulfamoyl]-N-(3-fluorophenyl)thiophene-2-carboxamide?
The canonical SMILES for 4-[ethyl(methyl)sulfamoyl]-N-(3-fluorophenyl)thiophene-2-carboxamide is CCN(C)S(=O)(=O)c1csc(C(=O)Nc2cccc(F)c2)c1.
What is the InChIKey of 4-[ethyl(methyl)sulfamoyl]-N-(3-fluorophenyl)thiophene-2-carboxamide?
The InChIKey is CKMITBUOFZHMTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2O3S2/c1-3-17(2)22(19,20)12-8-13(21-9-12)14(18)16-11-6-4-5-10(15)7-11/h4-9H,3H2,1-2H3,(H,16,18).
What are the key properties of 4-[ethyl(methyl)sulfamoyl]-N-(3-fluorophenyl)thiophene-2-carboxamide?
4-[ethyl(methyl)sulfamoyl]-N-(3-fluorophenyl)thiophene-2-carboxamide has a molecular weight of 342.42 g/mol, XLogP of 2.78, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[ethyl(methyl)sulfamoyl]-N-(3-fluorophenyl)thiophene-2-carboxamide is sourced from PubChem (CID 6503172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).