4-[[(3S,4R)-4-methoxyoxolan-3-yl]sulfamoyl]-N-methylthiophene-2-carboxamide

C11H16N2O5S2 — CID 131910790

IUPAC4-[[(3S,4R)-4-methoxyoxolan-3-yl]sulfamoyl]-N-methylthiophene-2-carboxamide
SMILESCNC(=O)c1cc(S(=O)(=O)N[C@H]2COC[C@@H]2OC)cs1
InChIInChI=1S/C11H16N2O5S2/c1-12-11(14)10-3-7(6-19-10)20(15,16)13-8-4-18-5-9(8)17-2/h3,6,8-9,13H,4-5H2,1-2H3,(H,12,14)/t8-,9-/m0/s1
InChIKeyIOFJDTPIHRIOAI-IUCAKERBSA-N
MW320.39 g/mol
LogP-0.20
Rot. Bonds5

About 4-[[(3S,4R)-4-methoxyoxolan-3-yl]sulfamoyl]-N-methylthiophene-2-carboxamide

4-[[(3S,4R)-4-methoxyoxolan-3-yl]sulfamoyl]-N-methylthiophene-2-carboxamide (PubChem CID 131910790) has the molecular formula C11H16N2O5S2 and a molecular weight of 320.39 g/mol. Its IUPAC name is 4-[[(3S,4R)-4-methoxyoxolan-3-yl]sulfamoyl]-N-methylthiophene-2-carboxamide.

Molecular Properties

Compound Name4-[[(3S,4R)-4-methoxyoxolan-3-yl]sulfamoyl]-N-methylthiophene-2-carboxamide
PubChem CID131910790
Molecular FormulaC11H16N2O5S2
Molecular Weight320.39 g/mol
Exact Mass320.05
IUPAC Name4-[[(3S,4R)-4-methoxyoxolan-3-yl]sulfamoyl]-N-methylthiophene-2-carboxamide
SMILESCNC(=O)c1cc(S(=O)(=O)N[C@H]2COC[C@@H]2OC)cs1
InChIInChI=1S/C11H16N2O5S2/c1-12-11(14)10-3-7(6-19-10)20(15,16)13-8-4-18-5-9(8)17-2/h3,6,8-9,13H,4-5H2,1-2H3,(H,12,14)/t8-,9-/m0/s1
InChIKeyIOFJDTPIHRIOAI-IUCAKERBSA-N
XLogP-0.20
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 5-0.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[4-[4-[[(3S,4S)-4-methoxyoxolan-3-yl]sulfamoyl]phenyl]phenyl]acetamide
CID 166237614
4-[(2,4-dimethoxyphenyl)sulfamoyl]-N-methylthiophene-2-carboxamide
CID 6503913
4-[[(3S)-3,4-dihydro-2H-chromen-3-yl]methylsulfamoyl]-N-methylthiophene-2-carboxamide
CID 97117712
methyl 2-[[5-(methylcarbamoyl)thiophen-3-yl]sulfonylamino]benzoate
CID 6503946
4-(oxan-3-ylsulfamoyl)thiophene-2-carboxylic acid
CID 55248976
4-chloro-2,5-dimethoxy-N-[(3S,4R)-4-methoxyoxolan-3-yl]benzenesulfonamide
CID 131917221
4-(azepan-1-ylsulfonyl)-N-methylthiophene-2-carboxamide
CID 6503439
5-chloro-N-[(3S,4R)-4-methoxyoxolan-3-yl]thiophene-2-carboxamide
CID 122564714
N-methyl-4-[[(4S)-2,3,4,5-tetrahydro-1-benzoxepin-4-yl]methylsulfamoyl]thiophene-2-carboxamide
CID 97204550
4-[(2,4-dimethylcyclohexyl)sulfamoyl]thiophene-2-carboxylic acid
CID 63993923
2-[[5-(methylcarbamoyl)thiophen-3-yl]sulfonylamino]benzoic acid
CID 27261800
4-[(3-fluorophenyl)sulfamoyl]-N-methylthiophene-2-carboxamide
CID 6503928

Frequently Asked Questions

What is the IUPAC name of 4-[[(3S,4R)-4-methoxyoxolan-3-yl]sulfamoyl]-N-methylthiophene-2-carboxamide?
The IUPAC name of 4-[[(3S,4R)-4-methoxyoxolan-3-yl]sulfamoyl]-N-methylthiophene-2-carboxamide (CID 131910790) is 4-[[(3S,4R)-4-methoxyoxolan-3-yl]sulfamoyl]-N-methylthiophene-2-carboxamide.
What is the SMILES notation for 4-[[(3S,4R)-4-methoxyoxolan-3-yl]sulfamoyl]-N-methylthiophene-2-carboxamide?
The canonical SMILES for 4-[[(3S,4R)-4-methoxyoxolan-3-yl]sulfamoyl]-N-methylthiophene-2-carboxamide is CNC(=O)c1cc(S(=O)(=O)N[C@H]2COC[C@@H]2OC)cs1.
What is the InChIKey of 4-[[(3S,4R)-4-methoxyoxolan-3-yl]sulfamoyl]-N-methylthiophene-2-carboxamide?
The InChIKey is IOFJDTPIHRIOAI-IUCAKERBSA-N. The full InChI is InChI=1S/C11H16N2O5S2/c1-12-11(14)10-3-7(6-19-10)20(15,16)13-8-4-18-5-9(8)17-2/h3,6,8-9,13H,4-5H2,1-2H3,(H,12,14)/t8-,9-/m0/s1.
What are the key properties of 4-[[(3S,4R)-4-methoxyoxolan-3-yl]sulfamoyl]-N-methylthiophene-2-carboxamide?
4-[[(3S,4R)-4-methoxyoxolan-3-yl]sulfamoyl]-N-methylthiophene-2-carboxamide has a molecular weight of 320.39 g/mol, XLogP of -0.20, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[(3S,4R)-4-methoxyoxolan-3-yl]sulfamoyl]-N-methylthiophene-2-carboxamide is sourced from PubChem (CID 131910790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).