N-(2,5-dimethylfuran-3-yl)sulfonyl-2-(2-methylphenyl)acetamide

C15H17NO4S — CID 86782475

IUPACN-(2,5-dimethylfuran-3-yl)sulfonyl-2-(2-methylphenyl)acetamide
SMILESCc1cc(S(=O)(=O)NC(=O)Cc2ccccc2C)c(C)o1
InChIInChI=1S/C15H17NO4S/c1-10-6-4-5-7-13(10)9-15(17)16-21(18,19)14-8-11(2)20-12(14)3/h4-8H,9H2,1-3H3,(H,16,17)
InChIKeyHSNXGGGTUOYHRZ-UHFFFAOYSA-N
MW307.37 g/mol
LogP2.25
Rot. Bonds4

About N-(2,5-dimethylfuran-3-yl)sulfonyl-2-(2-methylphenyl)acetamide

N-(2,5-dimethylfuran-3-yl)sulfonyl-2-(2-methylphenyl)acetamide (PubChem CID 86782475) has the molecular formula C15H17NO4S and a molecular weight of 307.37 g/mol. Its IUPAC name is N-(2,5-dimethylfuran-3-yl)sulfonyl-2-(2-methylphenyl)acetamide.

Molecular Properties

Compound NameN-(2,5-dimethylfuran-3-yl)sulfonyl-2-(2-methylphenyl)acetamide
PubChem CID86782475
Molecular FormulaC15H17NO4S
Molecular Weight307.37 g/mol
Exact Mass307.09
IUPAC NameN-(2,5-dimethylfuran-3-yl)sulfonyl-2-(2-methylphenyl)acetamide
SMILESCc1cc(S(=O)(=O)NC(=O)Cc2ccccc2C)c(C)o1
InChIInChI=1S/C15H17NO4S/c1-10-6-4-5-7-13(10)9-15(17)16-21(18,19)14-8-11(2)20-12(14)3/h4-8H,9H2,1-3H3,(H,16,17)
InChIKeyHSNXGGGTUOYHRZ-UHFFFAOYSA-N
XLogP2.25
TPSA76.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.37
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethylfuran-3-yl)sulfonyl-2-(2-methylphenyl)acetamide?
The IUPAC name of N-(2,5-dimethylfuran-3-yl)sulfonyl-2-(2-methylphenyl)acetamide (CID 86782475) is N-(2,5-dimethylfuran-3-yl)sulfonyl-2-(2-methylphenyl)acetamide.
What is the SMILES notation for N-(2,5-dimethylfuran-3-yl)sulfonyl-2-(2-methylphenyl)acetamide?
The canonical SMILES for N-(2,5-dimethylfuran-3-yl)sulfonyl-2-(2-methylphenyl)acetamide is Cc1cc(S(=O)(=O)NC(=O)Cc2ccccc2C)c(C)o1.
What is the InChIKey of N-(2,5-dimethylfuran-3-yl)sulfonyl-2-(2-methylphenyl)acetamide?
The InChIKey is HSNXGGGTUOYHRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO4S/c1-10-6-4-5-7-13(10)9-15(17)16-21(18,19)14-8-11(2)20-12(14)3/h4-8H,9H2,1-3H3,(H,16,17).
What are the key properties of N-(2,5-dimethylfuran-3-yl)sulfonyl-2-(2-methylphenyl)acetamide?
N-(2,5-dimethylfuran-3-yl)sulfonyl-2-(2-methylphenyl)acetamide has a molecular weight of 307.37 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethylfuran-3-yl)sulfonyl-2-(2-methylphenyl)acetamide is sourced from PubChem (CID 86782475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).