2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide

C10H13FN2O3S — CID 1258981

IUPAC2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide
SMILESCCN(CC(N)=O)S(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C10H13FN2O3S/c1-2-13(7-10(12)14)17(15,16)9-5-3-8(11)4-6-9/h3-6H,2,7H2,1H3,(H2,12,14)
InChIKeyCERCRJJKHBQLAX-UHFFFAOYSA-N
MW260.29 g/mol
LogP0.32
Rot. Bonds5

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

2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide (PubChem CID 1258981) has the molecular formula C10H13FN2O3S and a molecular weight of 260.29 g/mol. Its IUPAC name is 2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide.

Molecular Properties

Compound Name2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide
PubChem CID1258981
Molecular FormulaC10H13FN2O3S
Molecular Weight260.29 g/mol
Exact Mass260.06
IUPAC Name2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide
SMILESCCN(CC(N)=O)S(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C10H13FN2O3S/c1-2-13(7-10(12)14)17(15,16)9-5-3-8(11)4-6-9/h3-6H,2,7H2,1H3,(H2,12,14)
InChIKeyCERCRJJKHBQLAX-UHFFFAOYSA-N
XLogP0.32
TPSA80.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide?
The IUPAC name of 2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide (CID 1258981) is 2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide.
What is the SMILES notation for 2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide?
The canonical SMILES for 2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide is CCN(CC(N)=O)S(=O)(=O)c1ccc(F)cc1.
What is the InChIKey of 2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide?
The InChIKey is CERCRJJKHBQLAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN2O3S/c1-2-13(7-10(12)14)17(15,16)9-5-3-8(11)4-6-9/h3-6H,2,7H2,1H3,(H2,12,14).
What are the key properties of 2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide?
2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide has a molecular weight of 260.29 g/mol, XLogP of 0.32, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide is sourced from PubChem (CID 1258981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).