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

C17H19FN2O4S — CID 113060704

IUPACN-[2-[(4-fluorophenyl)sulfonylamino]ethyl]-N-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(N(CCNS(=O)(=O)c2ccc(F)cc2)C(C)=O)cc1
InChIInChI=1S/C17H19FN2O4S/c1-13(21)20(15-5-7-16(24-2)8-6-15)12-11-19-25(22,23)17-9-3-14(18)4-10-17/h3-10,19H,11-12H2,1-2H3
InChIKeyLUDWIJSRJIPUEJ-UHFFFAOYSA-N
MW366.41 g/mol
LogP2.17
Rot. Bonds7

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

N-[2-[(4-fluorophenyl)sulfonylamino]ethyl]-N-(4-methoxyphenyl)acetamide (PubChem CID 113060704) has the molecular formula C17H19FN2O4S and a molecular weight of 366.41 g/mol. Its IUPAC name is N-[2-[(4-fluorophenyl)sulfonylamino]ethyl]-N-(4-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-[2-[(4-fluorophenyl)sulfonylamino]ethyl]-N-(4-methoxyphenyl)acetamide
PubChem CID113060704
Molecular FormulaC17H19FN2O4S
Molecular Weight366.41 g/mol
Exact Mass366.10
IUPAC NameN-[2-[(4-fluorophenyl)sulfonylamino]ethyl]-N-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(N(CCNS(=O)(=O)c2ccc(F)cc2)C(C)=O)cc1
InChIInChI=1S/C17H19FN2O4S/c1-13(21)20(15-5-7-16(24-2)8-6-15)12-11-19-25(22,23)17-9-3-14(18)4-10-17/h3-10,19H,11-12H2,1-2H3
InChIKeyLUDWIJSRJIPUEJ-UHFFFAOYSA-N
XLogP2.17
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.41
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-[(4-fluorophenyl)sulfonylamino]ethyl]-N-(4-methoxyphenyl)acetamide?
The IUPAC name of N-[2-[(4-fluorophenyl)sulfonylamino]ethyl]-N-(4-methoxyphenyl)acetamide (CID 113060704) is N-[2-[(4-fluorophenyl)sulfonylamino]ethyl]-N-(4-methoxyphenyl)acetamide.
What is the SMILES notation for N-[2-[(4-fluorophenyl)sulfonylamino]ethyl]-N-(4-methoxyphenyl)acetamide?
The canonical SMILES for N-[2-[(4-fluorophenyl)sulfonylamino]ethyl]-N-(4-methoxyphenyl)acetamide is COc1ccc(N(CCNS(=O)(=O)c2ccc(F)cc2)C(C)=O)cc1.
What is the InChIKey of N-[2-[(4-fluorophenyl)sulfonylamino]ethyl]-N-(4-methoxyphenyl)acetamide?
The InChIKey is LUDWIJSRJIPUEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2O4S/c1-13(21)20(15-5-7-16(24-2)8-6-15)12-11-19-25(22,23)17-9-3-14(18)4-10-17/h3-10,19H,11-12H2,1-2H3.
What are the key properties of N-[2-[(4-fluorophenyl)sulfonylamino]ethyl]-N-(4-methoxyphenyl)acetamide?
N-[2-[(4-fluorophenyl)sulfonylamino]ethyl]-N-(4-methoxyphenyl)acetamide has a molecular weight of 366.41 g/mol, XLogP of 2.17, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(4-fluorophenyl)sulfonylamino]ethyl]-N-(4-methoxyphenyl)acetamide is sourced from PubChem (CID 113060704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).