3-(morpholin-4-ylsulfamoyl)thiophene-2-carboxylic acid

C9H12N2O5S2 — CID 17221141

IUPAC3-(morpholin-4-ylsulfamoyl)thiophene-2-carboxylic acid
SMILESO=C(O)c1sccc1S(=O)(=O)NN1CCOCC1
InChIInChI=1S/C9H12N2O5S2/c12-9(13)8-7(1-6-17-8)18(14,15)10-11-2-4-16-5-3-11/h1,6,10H,2-5H2,(H,12,13)
InChIKeyLSKDOHHPHVPXFF-UHFFFAOYSA-N
MW292.34 g/mol
LogP-0.03
Rot. Bonds4

About 3-(morpholin-4-ylsulfamoyl)thiophene-2-carboxylic acid

3-(morpholin-4-ylsulfamoyl)thiophene-2-carboxylic acid (PubChem CID 17221141) has the molecular formula C9H12N2O5S2 and a molecular weight of 292.34 g/mol. Its IUPAC name is 3-(morpholin-4-ylsulfamoyl)thiophene-2-carboxylic acid.

Molecular Properties

Compound Name3-(morpholin-4-ylsulfamoyl)thiophene-2-carboxylic acid
PubChem CID17221141
Molecular FormulaC9H12N2O5S2
Molecular Weight292.34 g/mol
Exact Mass292.02
IUPAC Name3-(morpholin-4-ylsulfamoyl)thiophene-2-carboxylic acid
SMILESO=C(O)c1sccc1S(=O)(=O)NN1CCOCC1
InChIInChI=1S/C9H12N2O5S2/c12-9(13)8-7(1-6-17-8)18(14,15)10-11-2-4-16-5-3-11/h1,6,10H,2-5H2,(H,12,13)
InChIKeyLSKDOHHPHVPXFF-UHFFFAOYSA-N
XLogP-0.03
TPSA95.94 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-(morpholin-4-ylsulfamoyl)thiophene-2-carboxylic acid?
The IUPAC name of 3-(morpholin-4-ylsulfamoyl)thiophene-2-carboxylic acid (CID 17221141) is 3-(morpholin-4-ylsulfamoyl)thiophene-2-carboxylic acid.
What is the SMILES notation for 3-(morpholin-4-ylsulfamoyl)thiophene-2-carboxylic acid?
The canonical SMILES for 3-(morpholin-4-ylsulfamoyl)thiophene-2-carboxylic acid is O=C(O)c1sccc1S(=O)(=O)NN1CCOCC1.
What is the InChIKey of 3-(morpholin-4-ylsulfamoyl)thiophene-2-carboxylic acid?
The InChIKey is LSKDOHHPHVPXFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O5S2/c12-9(13)8-7(1-6-17-8)18(14,15)10-11-2-4-16-5-3-11/h1,6,10H,2-5H2,(H,12,13).
What are the key properties of 3-(morpholin-4-ylsulfamoyl)thiophene-2-carboxylic acid?
3-(morpholin-4-ylsulfamoyl)thiophene-2-carboxylic acid has a molecular weight of 292.34 g/mol, XLogP of -0.03, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(morpholin-4-ylsulfamoyl)thiophene-2-carboxylic acid is sourced from PubChem (CID 17221141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).