4-methoxy-N-(4-sulfamoylphenyl)thiophene-2-carboxamide

C12H12N2O4S2 — CID 79459948

IUPAC4-methoxy-N-(4-sulfamoylphenyl)thiophene-2-carboxamide
SMILESCOc1csc(C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1
InChIInChI=1S/C12H12N2O4S2/c1-18-9-6-11(19-7-9)12(15)14-8-2-4-10(5-3-8)20(13,16)17/h2-7H,1H3,(H,14,15)(H2,13,16,17)
InChIKeyHJKYDKXNRXIURT-UHFFFAOYSA-N
MW312.37 g/mol
LogP1.66
Rot. Bonds4

About 4-methoxy-N-(4-sulfamoylphenyl)thiophene-2-carboxamide

4-methoxy-N-(4-sulfamoylphenyl)thiophene-2-carboxamide (PubChem CID 79459948) has the molecular formula C12H12N2O4S2 and a molecular weight of 312.37 g/mol. Its IUPAC name is 4-methoxy-N-(4-sulfamoylphenyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name4-methoxy-N-(4-sulfamoylphenyl)thiophene-2-carboxamide
PubChem CID79459948
Molecular FormulaC12H12N2O4S2
Molecular Weight312.37 g/mol
Exact Mass312.02
IUPAC Name4-methoxy-N-(4-sulfamoylphenyl)thiophene-2-carboxamide
SMILESCOc1csc(C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1
InChIInChI=1S/C12H12N2O4S2/c1-18-9-6-11(19-7-9)12(15)14-8-2-4-10(5-3-8)20(13,16)17/h2-7H,1H3,(H,14,15)(H2,13,16,17)
InChIKeyHJKYDKXNRXIURT-UHFFFAOYSA-N
XLogP1.66
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-methoxy-N-methyl-N-(4-sulfamoylphenyl)thiophene-2-carboxamide
CID 81119223
N-[4-[(dimethylamino)methyl]phenyl]-4-methoxythiophene-2-carboxamide
CID 71982666
N-[4-(2-amino-2-sulfanylideneethoxy)phenyl]-4-methoxythiophene-2-carboxamide
CID 81121383
N-(3-acetylphenyl)-4-methoxythiophene-2-carboxamide
CID 79459873
5-methyl-N-(4-sulfamoylphenyl)thiophene-2-carboxamide
CID 36865757
2,6-dimethoxy-N-(4-sulfamoylphenyl)benzamide
CID 954656
N-[4-fluoro-3-[(Z)-N'-hydroxycarbamimidoyl]phenyl]-4-methoxythiophene-2-carboxamide
CID 81119743
methyl 6-[(4-sulfamoylphenyl)carbamoyl]naphthalene-2-carboxylate
CID 59762981
7-methoxy-N-(4-sulfamoylphenyl)-1-benzofuran-2-carboxamide
CID 40888598
N-[4-(3-hydroxyprop-1-ynyl)-3-methylphenyl]-4-methoxythiophene-2-carboxamide
CID 81121633
4-[(4-methoxyphenyl)methylsulfamoyl]-N-phenylthiophene-2-carboxamide
CID 6504058
2-(3-methoxyphenoxy)-N-(4-sulfamoylphenyl)acetamide
CID 19204089

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(4-sulfamoylphenyl)thiophene-2-carboxamide?
The IUPAC name of 4-methoxy-N-(4-sulfamoylphenyl)thiophene-2-carboxamide (CID 79459948) is 4-methoxy-N-(4-sulfamoylphenyl)thiophene-2-carboxamide.
What is the SMILES notation for 4-methoxy-N-(4-sulfamoylphenyl)thiophene-2-carboxamide?
The canonical SMILES for 4-methoxy-N-(4-sulfamoylphenyl)thiophene-2-carboxamide is COc1csc(C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1.
What is the InChIKey of 4-methoxy-N-(4-sulfamoylphenyl)thiophene-2-carboxamide?
The InChIKey is HJKYDKXNRXIURT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O4S2/c1-18-9-6-11(19-7-9)12(15)14-8-2-4-10(5-3-8)20(13,16)17/h2-7H,1H3,(H,14,15)(H2,13,16,17).
What are the key properties of 4-methoxy-N-(4-sulfamoylphenyl)thiophene-2-carboxamide?
4-methoxy-N-(4-sulfamoylphenyl)thiophene-2-carboxamide has a molecular weight of 312.37 g/mol, XLogP of 1.66, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(4-sulfamoylphenyl)thiophene-2-carboxamide is sourced from PubChem (CID 79459948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).