4-morpholin-4-ylsulfonylthiophene-2-carboxamide

C9H12N2O4S2 — CID 6486031

IUPAC4-morpholin-4-ylsulfonylthiophene-2-carboxamide
SMILESNC(=O)c1cc(S(=O)(=O)N2CCOCC2)cs1
InChIInChI=1S/C9H12N2O4S2/c10-9(12)8-5-7(6-16-8)17(13,14)11-1-3-15-4-2-11/h5-6H,1-4H2,(H2,10,12)
InChIKeyCFDIPGDYLCDIMN-UHFFFAOYSA-N
MW276.34 g/mol
LogP-0.13
Rot. Bonds3

About 4-morpholin-4-ylsulfonylthiophene-2-carboxamide

4-morpholin-4-ylsulfonylthiophene-2-carboxamide (PubChem CID 6486031) has the molecular formula C9H12N2O4S2 and a molecular weight of 276.34 g/mol. Its IUPAC name is 4-morpholin-4-ylsulfonylthiophene-2-carboxamide.

Molecular Properties

Compound Name4-morpholin-4-ylsulfonylthiophene-2-carboxamide
PubChem CID6486031
Molecular FormulaC9H12N2O4S2
Molecular Weight276.34 g/mol
Exact Mass276.02
IUPAC Name4-morpholin-4-ylsulfonylthiophene-2-carboxamide
SMILESNC(=O)c1cc(S(=O)(=O)N2CCOCC2)cs1
InChIInChI=1S/C9H12N2O4S2/c10-9(12)8-5-7(6-16-8)17(13,14)11-1-3-15-4-2-11/h5-6H,1-4H2,(H2,10,12)
InChIKeyCFDIPGDYLCDIMN-UHFFFAOYSA-N
XLogP-0.13
TPSA89.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 5-0.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-morpholin-4-ylsulfonylthiophene-2-carboxamide?
The IUPAC name of 4-morpholin-4-ylsulfonylthiophene-2-carboxamide (CID 6486031) is 4-morpholin-4-ylsulfonylthiophene-2-carboxamide.
What is the SMILES notation for 4-morpholin-4-ylsulfonylthiophene-2-carboxamide?
The canonical SMILES for 4-morpholin-4-ylsulfonylthiophene-2-carboxamide is NC(=O)c1cc(S(=O)(=O)N2CCOCC2)cs1.
What is the InChIKey of 4-morpholin-4-ylsulfonylthiophene-2-carboxamide?
The InChIKey is CFDIPGDYLCDIMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O4S2/c10-9(12)8-5-7(6-16-8)17(13,14)11-1-3-15-4-2-11/h5-6H,1-4H2,(H2,10,12).
What are the key properties of 4-morpholin-4-ylsulfonylthiophene-2-carboxamide?
4-morpholin-4-ylsulfonylthiophene-2-carboxamide has a molecular weight of 276.34 g/mol, XLogP of -0.13, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-morpholin-4-ylsulfonylthiophene-2-carboxamide is sourced from PubChem (CID 6486031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).