5-(methylsulfamoyl)-N-piperidin-3-ylfuran-2-carboxamide

C11H17N3O4S — CID 112530964

IUPAC5-(methylsulfamoyl)-N-piperidin-3-ylfuran-2-carboxamide
SMILESCNS(=O)(=O)c1ccc(C(=O)NC2CCCNC2)o1
InChIInChI=1S/C11H17N3O4S/c1-12-19(16,17)10-5-4-9(18-10)11(15)14-8-3-2-6-13-7-8/h4-5,8,12-13H,2-3,6-7H2,1H3,(H,14,15)
InChIKeyFJNPNGNOTMELDF-UHFFFAOYSA-N
MW287.34 g/mol
LogP-0.33
Rot. Bonds4

About 5-(methylsulfamoyl)-N-piperidin-3-ylfuran-2-carboxamide

5-(methylsulfamoyl)-N-piperidin-3-ylfuran-2-carboxamide (PubChem CID 112530964) has the molecular formula C11H17N3O4S and a molecular weight of 287.34 g/mol. Its IUPAC name is 5-(methylsulfamoyl)-N-piperidin-3-ylfuran-2-carboxamide.

Molecular Properties

Compound Name5-(methylsulfamoyl)-N-piperidin-3-ylfuran-2-carboxamide
PubChem CID112530964
Molecular FormulaC11H17N3O4S
Molecular Weight287.34 g/mol
Exact Mass287.09
IUPAC Name5-(methylsulfamoyl)-N-piperidin-3-ylfuran-2-carboxamide
SMILESCNS(=O)(=O)c1ccc(C(=O)NC2CCCNC2)o1
InChIInChI=1S/C11H17N3O4S/c1-12-19(16,17)10-5-4-9(18-10)11(15)14-8-3-2-6-13-7-8/h4-5,8,12-13H,2-3,6-7H2,1H3,(H,14,15)
InChIKeyFJNPNGNOTMELDF-UHFFFAOYSA-N
XLogP-0.33
TPSA100.44 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.34
LogP ≤ 5-0.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(methylsulfamoyl)-N-piperidin-3-ylfuran-2-carboxamide?
The IUPAC name of 5-(methylsulfamoyl)-N-piperidin-3-ylfuran-2-carboxamide (CID 112530964) is 5-(methylsulfamoyl)-N-piperidin-3-ylfuran-2-carboxamide.
What is the SMILES notation for 5-(methylsulfamoyl)-N-piperidin-3-ylfuran-2-carboxamide?
The canonical SMILES for 5-(methylsulfamoyl)-N-piperidin-3-ylfuran-2-carboxamide is CNS(=O)(=O)c1ccc(C(=O)NC2CCCNC2)o1.
What is the InChIKey of 5-(methylsulfamoyl)-N-piperidin-3-ylfuran-2-carboxamide?
The InChIKey is FJNPNGNOTMELDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O4S/c1-12-19(16,17)10-5-4-9(18-10)11(15)14-8-3-2-6-13-7-8/h4-5,8,12-13H,2-3,6-7H2,1H3,(H,14,15).
What are the key properties of 5-(methylsulfamoyl)-N-piperidin-3-ylfuran-2-carboxamide?
5-(methylsulfamoyl)-N-piperidin-3-ylfuran-2-carboxamide has a molecular weight of 287.34 g/mol, XLogP of -0.33, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methylsulfamoyl)-N-piperidin-3-ylfuran-2-carboxamide is sourced from PubChem (CID 112530964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).