2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)acetamide

C15H17FN2O4S — CID 3163583

IUPAC2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)acetamide
SMILESCCN(CC(=O)NCc1ccco1)S(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C15H17FN2O4S/c1-2-18(11-15(19)17-10-13-4-3-9-22-13)23(20,21)14-7-5-12(16)6-8-14/h3-9H,2,10-11H2,1H3,(H,17,19)
InChIKeyHIIHWQFNRNRELI-UHFFFAOYSA-N
MW340.38 g/mol
LogP1.75
Rot. Bonds7

About 2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)acetamide

2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)acetamide (PubChem CID 3163583) has the molecular formula C15H17FN2O4S and a molecular weight of 340.38 g/mol. Its IUPAC name is 2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)acetamide
PubChem CID3163583
Molecular FormulaC15H17FN2O4S
Molecular Weight340.38 g/mol
Exact Mass340.09
IUPAC Name2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)acetamide
SMILESCCN(CC(=O)NCc1ccco1)S(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C15H17FN2O4S/c1-2-18(11-15(19)17-10-13-4-3-9-22-13)23(20,21)14-7-5-12(16)6-8-14/h3-9H,2,10-11H2,1H3,(H,17,19)
InChIKeyHIIHWQFNRNRELI-UHFFFAOYSA-N
XLogP1.75
TPSA79.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)acetamide?
The IUPAC name of 2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)acetamide (CID 3163583) is 2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)acetamide.
What is the SMILES notation for 2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)acetamide?
The canonical SMILES for 2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)acetamide is CCN(CC(=O)NCc1ccco1)S(=O)(=O)c1ccc(F)cc1.
What is the InChIKey of 2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)acetamide?
The InChIKey is HIIHWQFNRNRELI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2O4S/c1-2-18(11-15(19)17-10-13-4-3-9-22-13)23(20,21)14-7-5-12(16)6-8-14/h3-9H,2,10-11H2,1H3,(H,17,19).
What are the key properties of 2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)acetamide?
2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)acetamide has a molecular weight of 340.38 g/mol, XLogP of 1.75, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)acetamide is sourced from PubChem (CID 3163583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).