5-(dimethylsulfamoyl)-N-(3-methylcyclopentyl)furan-2-carboxamide

C13H20N2O4S — CID 114550104

IUPAC5-(dimethylsulfamoyl)-N-(3-methylcyclopentyl)furan-2-carboxamide
SMILESCC1CCC(NC(=O)c2ccc(S(=O)(=O)N(C)C)o2)C1
InChIInChI=1S/C13H20N2O4S/c1-9-4-5-10(8-9)14-13(16)11-6-7-12(19-11)20(17,18)15(2)3/h6-7,9-10H,4-5,8H2,1-3H3,(H,14,16)
InChIKeyIZWPRVUMNOORQJ-UHFFFAOYSA-N
MW300.38 g/mol
LogP1.45
Rot. Bonds4

About 5-(dimethylsulfamoyl)-N-(3-methylcyclopentyl)furan-2-carboxamide

5-(dimethylsulfamoyl)-N-(3-methylcyclopentyl)furan-2-carboxamide (PubChem CID 114550104) has the molecular formula C13H20N2O4S and a molecular weight of 300.38 g/mol. Its IUPAC name is 5-(dimethylsulfamoyl)-N-(3-methylcyclopentyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-(dimethylsulfamoyl)-N-(3-methylcyclopentyl)furan-2-carboxamide
PubChem CID114550104
Molecular FormulaC13H20N2O4S
Molecular Weight300.38 g/mol
Exact Mass300.11
IUPAC Name5-(dimethylsulfamoyl)-N-(3-methylcyclopentyl)furan-2-carboxamide
SMILESCC1CCC(NC(=O)c2ccc(S(=O)(=O)N(C)C)o2)C1
InChIInChI=1S/C13H20N2O4S/c1-9-4-5-10(8-9)14-13(16)11-6-7-12(19-11)20(17,18)15(2)3/h6-7,9-10H,4-5,8H2,1-3H3,(H,14,16)
InChIKeyIZWPRVUMNOORQJ-UHFFFAOYSA-N
XLogP1.45
TPSA79.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.38
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(dimethylsulfamoyl)-N-(3-methylcyclopentyl)furan-2-carboxamide?
The IUPAC name of 5-(dimethylsulfamoyl)-N-(3-methylcyclopentyl)furan-2-carboxamide (CID 114550104) is 5-(dimethylsulfamoyl)-N-(3-methylcyclopentyl)furan-2-carboxamide.
What is the SMILES notation for 5-(dimethylsulfamoyl)-N-(3-methylcyclopentyl)furan-2-carboxamide?
The canonical SMILES for 5-(dimethylsulfamoyl)-N-(3-methylcyclopentyl)furan-2-carboxamide is CC1CCC(NC(=O)c2ccc(S(=O)(=O)N(C)C)o2)C1.
What is the InChIKey of 5-(dimethylsulfamoyl)-N-(3-methylcyclopentyl)furan-2-carboxamide?
The InChIKey is IZWPRVUMNOORQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O4S/c1-9-4-5-10(8-9)14-13(16)11-6-7-12(19-11)20(17,18)15(2)3/h6-7,9-10H,4-5,8H2,1-3H3,(H,14,16).
What are the key properties of 5-(dimethylsulfamoyl)-N-(3-methylcyclopentyl)furan-2-carboxamide?
5-(dimethylsulfamoyl)-N-(3-methylcyclopentyl)furan-2-carboxamide has a molecular weight of 300.38 g/mol, XLogP of 1.45, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(dimethylsulfamoyl)-N-(3-methylcyclopentyl)furan-2-carboxamide is sourced from PubChem (CID 114550104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).