N-cyclooctyl-N-methyl-5-(methylsulfamoyl)furan-2-carboxamide

C15H24N2O4S — CID 71934799

IUPACN-cyclooctyl-N-methyl-5-(methylsulfamoyl)furan-2-carboxamide
SMILESCNS(=O)(=O)c1ccc(C(=O)N(C)C2CCCCCCC2)o1
InChIInChI=1S/C15H24N2O4S/c1-16-22(19,20)14-11-10-13(21-14)15(18)17(2)12-8-6-4-3-5-7-9-12/h10-12,16H,3-9H2,1-2H3
InChIKeyDGLBOQJBZCSUAI-UHFFFAOYSA-N
MW328.43 g/mol
LogP2.37
Rot. Bonds4

About N-cyclooctyl-N-methyl-5-(methylsulfamoyl)furan-2-carboxamide

N-cyclooctyl-N-methyl-5-(methylsulfamoyl)furan-2-carboxamide (PubChem CID 71934799) has the molecular formula C15H24N2O4S and a molecular weight of 328.43 g/mol. Its IUPAC name is N-cyclooctyl-N-methyl-5-(methylsulfamoyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-cyclooctyl-N-methyl-5-(methylsulfamoyl)furan-2-carboxamide
PubChem CID71934799
Molecular FormulaC15H24N2O4S
Molecular Weight328.43 g/mol
Exact Mass328.15
IUPAC NameN-cyclooctyl-N-methyl-5-(methylsulfamoyl)furan-2-carboxamide
SMILESCNS(=O)(=O)c1ccc(C(=O)N(C)C2CCCCCCC2)o1
InChIInChI=1S/C15H24N2O4S/c1-16-22(19,20)14-11-10-13(21-14)15(18)17(2)12-8-6-4-3-5-7-9-12/h10-12,16H,3-9H2,1-2H3
InChIKeyDGLBOQJBZCSUAI-UHFFFAOYSA-N
XLogP2.37
TPSA79.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.43
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclooctyl-N-methyl-5-(methylsulfamoyl)furan-2-carboxamide?
The IUPAC name of N-cyclooctyl-N-methyl-5-(methylsulfamoyl)furan-2-carboxamide (CID 71934799) is N-cyclooctyl-N-methyl-5-(methylsulfamoyl)furan-2-carboxamide.
What is the SMILES notation for N-cyclooctyl-N-methyl-5-(methylsulfamoyl)furan-2-carboxamide?
The canonical SMILES for N-cyclooctyl-N-methyl-5-(methylsulfamoyl)furan-2-carboxamide is CNS(=O)(=O)c1ccc(C(=O)N(C)C2CCCCCCC2)o1.
What is the InChIKey of N-cyclooctyl-N-methyl-5-(methylsulfamoyl)furan-2-carboxamide?
The InChIKey is DGLBOQJBZCSUAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O4S/c1-16-22(19,20)14-11-10-13(21-14)15(18)17(2)12-8-6-4-3-5-7-9-12/h10-12,16H,3-9H2,1-2H3.
What are the key properties of N-cyclooctyl-N-methyl-5-(methylsulfamoyl)furan-2-carboxamide?
N-cyclooctyl-N-methyl-5-(methylsulfamoyl)furan-2-carboxamide has a molecular weight of 328.43 g/mol, XLogP of 2.37, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclooctyl-N-methyl-5-(methylsulfamoyl)furan-2-carboxamide is sourced from PubChem (CID 71934799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).