N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-2,5-dimethylthiophene-3-carboxamide

C19H26N2O4S2 — CID 55384187

IUPACN-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-2,5-dimethylthiophene-3-carboxamide
SMILESCCOc1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)c1cc(C)sc1C
InChIInChI=1S/C19H26N2O4S2/c1-6-21(7-2)27(23,24)15-9-10-18(25-8-3)17(12-15)20-19(22)16-11-13(4)26-14(16)5/h9-12H,6-8H2,1-5H3,(H,20,22)
InChIKeyDSFOQDYNBAOASK-UHFFFAOYSA-N
MW410.56 g/mol
LogP4.05
Rot. Bonds8

About N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-2,5-dimethylthiophene-3-carboxamide

N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-2,5-dimethylthiophene-3-carboxamide (PubChem CID 55384187) has the molecular formula C19H26N2O4S2 and a molecular weight of 410.56 g/mol. Its IUPAC name is N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-2,5-dimethylthiophene-3-carboxamide.

Molecular Properties

Compound NameN-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-2,5-dimethylthiophene-3-carboxamide
PubChem CID55384187
Molecular FormulaC19H26N2O4S2
Molecular Weight410.56 g/mol
Exact Mass410.13
IUPAC NameN-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-2,5-dimethylthiophene-3-carboxamide
SMILESCCOc1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)c1cc(C)sc1C
InChIInChI=1S/C19H26N2O4S2/c1-6-21(7-2)27(23,24)15-9-10-18(25-8-3)17(12-15)20-19(22)16-11-13(4)26-14(16)5/h9-12H,6-8H2,1-5H3,(H,20,22)
InChIKeyDSFOQDYNBAOASK-UHFFFAOYSA-N
XLogP4.05
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.56
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,5-diethoxyphenyl)-2,5-dimethylthiophene-3-carboxamide
CID 36665080
N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-2-(methylamino)acetamide
CID 119683526
N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-2-methyl-3-nitrobenzamide
CID 26891825
N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-4-methoxybenzamide
CID 8501680
N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-4,5-dimethylthiophene-2-carboxamide
CID 31509802
N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-7-fluoro-2-methylquinoline-4-carboxamide
CID 46686472
N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-3-methoxybenzamide
CID 7936803
N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-2,3-dimethylbenzamide
CID 9467095
1-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-3-ethylthiourea
CID 8683228
N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-2,2-diphenylacetamide
CID 26891804
4-amino-N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]butanamide;hydrochloride
CID 119268072
3-[(4-ethoxy-3-methylphenyl)sulfonyl-ethylamino]propanoic acid
CID 61010738

Frequently Asked Questions

What is the IUPAC name of N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-2,5-dimethylthiophene-3-carboxamide?
The IUPAC name of N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-2,5-dimethylthiophene-3-carboxamide (CID 55384187) is N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-2,5-dimethylthiophene-3-carboxamide.
What is the SMILES notation for N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-2,5-dimethylthiophene-3-carboxamide?
The canonical SMILES for N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-2,5-dimethylthiophene-3-carboxamide is CCOc1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)c1cc(C)sc1C.
What is the InChIKey of N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-2,5-dimethylthiophene-3-carboxamide?
The InChIKey is DSFOQDYNBAOASK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O4S2/c1-6-21(7-2)27(23,24)15-9-10-18(25-8-3)17(12-15)20-19(22)16-11-13(4)26-14(16)5/h9-12H,6-8H2,1-5H3,(H,20,22).
What are the key properties of N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-2,5-dimethylthiophene-3-carboxamide?
N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-2,5-dimethylthiophene-3-carboxamide has a molecular weight of 410.56 g/mol, XLogP of 4.05, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-2,5-dimethylthiophene-3-carboxamide is sourced from PubChem (CID 55384187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).