4-methyl-N-[4-[(2-oxooxolan-3-yl)sulfamoyl]phenyl]thiophene-2-carboxamide

C16H16N2O5S2 — CID 126756514

IUPAC4-methyl-N-[4-[(2-oxooxolan-3-yl)sulfamoyl]phenyl]thiophene-2-carboxamide
SMILESCc1csc(C(=O)Nc2ccc(S(=O)(=O)NC3CCOC3=O)cc2)c1
InChIInChI=1S/C16H16N2O5S2/c1-10-8-14(24-9-10)15(19)17-11-2-4-12(5-3-11)25(21,22)18-13-6-7-23-16(13)20/h2-5,8-9,13,18H,6-7H2,1H3,(H,17,19)
InChIKeyZHEQZRIHGBEQQV-UHFFFAOYSA-N
MW380.45 g/mol
LogP1.90
Rot. Bonds5

About 4-methyl-N-[4-[(2-oxooxolan-3-yl)sulfamoyl]phenyl]thiophene-2-carboxamide

4-methyl-N-[4-[(2-oxooxolan-3-yl)sulfamoyl]phenyl]thiophene-2-carboxamide (PubChem CID 126756514) has the molecular formula C16H16N2O5S2 and a molecular weight of 380.45 g/mol. Its IUPAC name is 4-methyl-N-[4-[(2-oxooxolan-3-yl)sulfamoyl]phenyl]thiophene-2-carboxamide.

Molecular Properties

Compound Name4-methyl-N-[4-[(2-oxooxolan-3-yl)sulfamoyl]phenyl]thiophene-2-carboxamide
PubChem CID126756514
Molecular FormulaC16H16N2O5S2
Molecular Weight380.45 g/mol
Exact Mass380.05
IUPAC Name4-methyl-N-[4-[(2-oxooxolan-3-yl)sulfamoyl]phenyl]thiophene-2-carboxamide
SMILESCc1csc(C(=O)Nc2ccc(S(=O)(=O)NC3CCOC3=O)cc2)c1
InChIInChI=1S/C16H16N2O5S2/c1-10-8-14(24-9-10)15(19)17-11-2-4-12(5-3-11)25(21,22)18-13-6-7-23-16(13)20/h2-5,8-9,13,18H,6-7H2,1H3,(H,17,19)
InChIKeyZHEQZRIHGBEQQV-UHFFFAOYSA-N
XLogP1.90
TPSA101.57 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.45
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4,5-dibromo-N-[4-[[(3S)-2-oxooxolan-3-yl]sulfamoyl]phenyl]furan-2-carboxamide
CID 126737148
5-bromo-N-[4-[(2-oxooxolan-3-yl)sulfamoyl]phenyl]furan-2-carboxamide
CID 126756539
2-fluoro-N-[4-[[(3S)-2-oxooxolan-3-yl]sulfamoyl]phenyl]benzamide
CID 78318477
4-(methylamino)-N-(2-oxooxolan-3-yl)benzenesulfonamide
CID 135183680
4-ethoxy-N-[4-[[(3S)-2-oxooxolan-3-yl]sulfamoyl]phenyl]benzamide
CID 78318533
4-[(2-oxooxolan-3-yl)sulfamoyl]thiophene-2-carboxylic acid
CID 65416177
N-[4-[[(3S)-2-oxooxolan-3-yl]sulfamoyl]phenyl]heptanamide
CID 78318340
N-[4-[(6-methyl-3,4-dihydro-2H-chromen-4-yl)sulfamoyl]phenyl]acetamide
CID 108781692
N-(4-acetamidophenyl)-4-methylthiophene-2-carboxamide
CID 110861467
2-(3-fluorophenyl)-N-[4-[[(3S)-2-oxooxolan-3-yl]sulfamoyl]phenyl]acetamide
CID 135149146
4-(3-chloroanilino)-N-[(3S)-2-oxooxolan-3-yl]benzenesulfonamide
CID 129065761
4-cyano-N-(2-oxooxolan-3-yl)benzenesulfonamide
CID 43822806

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[4-[(2-oxooxolan-3-yl)sulfamoyl]phenyl]thiophene-2-carboxamide?
The IUPAC name of 4-methyl-N-[4-[(2-oxooxolan-3-yl)sulfamoyl]phenyl]thiophene-2-carboxamide (CID 126756514) is 4-methyl-N-[4-[(2-oxooxolan-3-yl)sulfamoyl]phenyl]thiophene-2-carboxamide.
What is the SMILES notation for 4-methyl-N-[4-[(2-oxooxolan-3-yl)sulfamoyl]phenyl]thiophene-2-carboxamide?
The canonical SMILES for 4-methyl-N-[4-[(2-oxooxolan-3-yl)sulfamoyl]phenyl]thiophene-2-carboxamide is Cc1csc(C(=O)Nc2ccc(S(=O)(=O)NC3CCOC3=O)cc2)c1.
What is the InChIKey of 4-methyl-N-[4-[(2-oxooxolan-3-yl)sulfamoyl]phenyl]thiophene-2-carboxamide?
The InChIKey is ZHEQZRIHGBEQQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O5S2/c1-10-8-14(24-9-10)15(19)17-11-2-4-12(5-3-11)25(21,22)18-13-6-7-23-16(13)20/h2-5,8-9,13,18H,6-7H2,1H3,(H,17,19).
What are the key properties of 4-methyl-N-[4-[(2-oxooxolan-3-yl)sulfamoyl]phenyl]thiophene-2-carboxamide?
4-methyl-N-[4-[(2-oxooxolan-3-yl)sulfamoyl]phenyl]thiophene-2-carboxamide has a molecular weight of 380.45 g/mol, XLogP of 1.90, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[4-[(2-oxooxolan-3-yl)sulfamoyl]phenyl]thiophene-2-carboxamide is sourced from PubChem (CID 126756514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).