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

C23H24FN3O5S — CID 653223

IUPAC2-[(4-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]acetamide
SMILESO=C(CN(Cc1ccco1)C(=O)CNS(=O)(=O)c1ccc(F)cc1)NCCc1ccccc1
InChIInChI=1S/C23H24FN3O5S/c24-19-8-10-21(11-9-19)33(30,31)26-15-23(29)27(16-20-7-4-14-32-20)17-22(28)25-13-12-18-5-2-1-3-6-18/h1-11,14,26H,12-13,15-17H2,(H,25,28)
InChIKeyHCGLTECIDHPCKI-UHFFFAOYSA-N
MW473.53 g/mol
LogP2.08
Rot. Bonds11

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

2-[(4-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]acetamide (PubChem CID 653223) has the molecular formula C23H24FN3O5S and a molecular weight of 473.53 g/mol. Its IUPAC name is 2-[(4-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]acetamide.

Molecular Properties

Compound Name2-[(4-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]acetamide
PubChem CID653223
Molecular FormulaC23H24FN3O5S
Molecular Weight473.53 g/mol
Exact Mass473.14
IUPAC Name2-[(4-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]acetamide
SMILESO=C(CN(Cc1ccco1)C(=O)CNS(=O)(=O)c1ccc(F)cc1)NCCc1ccccc1
InChIInChI=1S/C23H24FN3O5S/c24-19-8-10-21(11-9-19)33(30,31)26-15-23(29)27(16-20-7-4-14-32-20)17-22(28)25-13-12-18-5-2-1-3-6-18/h1-11,14,26H,12-13,15-17H2,(H,25,28)
InChIKeyHCGLTECIDHPCKI-UHFFFAOYSA-N
XLogP2.08
TPSA108.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500473.53
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]acetamide?
The IUPAC name of 2-[(4-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]acetamide (CID 653223) is 2-[(4-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]acetamide.
What is the SMILES notation for 2-[(4-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]acetamide?
The canonical SMILES for 2-[(4-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]acetamide is O=C(CN(Cc1ccco1)C(=O)CNS(=O)(=O)c1ccc(F)cc1)NCCc1ccccc1.
What is the InChIKey of 2-[(4-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]acetamide?
The InChIKey is HCGLTECIDHPCKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24FN3O5S/c24-19-8-10-21(11-9-19)33(30,31)26-15-23(29)27(16-20-7-4-14-32-20)17-22(28)25-13-12-18-5-2-1-3-6-18/h1-11,14,26H,12-13,15-17H2,(H,25,28).
What are the key properties of 2-[(4-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]acetamide?
2-[(4-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]acetamide has a molecular weight of 473.53 g/mol, XLogP of 2.08, 11 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-fluorophenyl)sulfonylamino]-N-(furan-2-ylmethyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]acetamide is sourced from PubChem (CID 653223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).