2-(2-fluorophenyl)-N-(3-morpholin-4-ylsulfonylphenyl)acetamide

C18H19FN2O4S — CID 3519434

IUPAC2-(2-fluorophenyl)-N-(3-morpholin-4-ylsulfonylphenyl)acetamide
SMILESO=C(Cc1ccccc1F)Nc1cccc(S(=O)(=O)N2CCOCC2)c1
InChIInChI=1S/C18H19FN2O4S/c19-17-7-2-1-4-14(17)12-18(22)20-15-5-3-6-16(13-15)26(23,24)21-8-10-25-11-9-21/h1-7,13H,8-12H2,(H,20,22)
InChIKeyJKTKKWZRZODVGT-UHFFFAOYSA-N
MW378.43 g/mol
LogP2.03
Rot. Bonds5

About 2-(2-fluorophenyl)-N-(3-morpholin-4-ylsulfonylphenyl)acetamide

2-(2-fluorophenyl)-N-(3-morpholin-4-ylsulfonylphenyl)acetamide (PubChem CID 3519434) has the molecular formula C18H19FN2O4S and a molecular weight of 378.43 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-N-(3-morpholin-4-ylsulfonylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-fluorophenyl)-N-(3-morpholin-4-ylsulfonylphenyl)acetamide
PubChem CID3519434
Molecular FormulaC18H19FN2O4S
Molecular Weight378.43 g/mol
Exact Mass378.10
IUPAC Name2-(2-fluorophenyl)-N-(3-morpholin-4-ylsulfonylphenyl)acetamide
SMILESO=C(Cc1ccccc1F)Nc1cccc(S(=O)(=O)N2CCOCC2)c1
InChIInChI=1S/C18H19FN2O4S/c19-17-7-2-1-4-14(17)12-18(22)20-15-5-3-6-16(13-15)26(23,24)21-8-10-25-11-9-21/h1-7,13H,8-12H2,(H,20,22)
InChIKeyJKTKKWZRZODVGT-UHFFFAOYSA-N
XLogP2.03
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.43
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-N-(3-morpholin-4-ylsulfonylphenyl)acetamide?
The IUPAC name of 2-(2-fluorophenyl)-N-(3-morpholin-4-ylsulfonylphenyl)acetamide (CID 3519434) is 2-(2-fluorophenyl)-N-(3-morpholin-4-ylsulfonylphenyl)acetamide.
What is the SMILES notation for 2-(2-fluorophenyl)-N-(3-morpholin-4-ylsulfonylphenyl)acetamide?
The canonical SMILES for 2-(2-fluorophenyl)-N-(3-morpholin-4-ylsulfonylphenyl)acetamide is O=C(Cc1ccccc1F)Nc1cccc(S(=O)(=O)N2CCOCC2)c1.
What is the InChIKey of 2-(2-fluorophenyl)-N-(3-morpholin-4-ylsulfonylphenyl)acetamide?
The InChIKey is JKTKKWZRZODVGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN2O4S/c19-17-7-2-1-4-14(17)12-18(22)20-15-5-3-6-16(13-15)26(23,24)21-8-10-25-11-9-21/h1-7,13H,8-12H2,(H,20,22).
What are the key properties of 2-(2-fluorophenyl)-N-(3-morpholin-4-ylsulfonylphenyl)acetamide?
2-(2-fluorophenyl)-N-(3-morpholin-4-ylsulfonylphenyl)acetamide has a molecular weight of 378.43 g/mol, XLogP of 2.03, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-N-(3-morpholin-4-ylsulfonylphenyl)acetamide is sourced from PubChem (CID 3519434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).