2-[2-(diethylamino)-2-oxoethyl]sulfonyl-N-(4-fluorophenyl)acetamide

C14H19FN2O4S — CID 39076319

IUPAC2-[2-(diethylamino)-2-oxoethyl]sulfonyl-N-(4-fluorophenyl)acetamide
SMILESCCN(CC)C(=O)CS(=O)(=O)CC(=O)Nc1ccc(F)cc1
InChIInChI=1S/C14H19FN2O4S/c1-3-17(4-2)14(19)10-22(20,21)9-13(18)16-12-7-5-11(15)6-8-12/h5-8H,3-4,9-10H2,1-2H3,(H,16,18)
InChIKeyMULQSOXFZLSOMC-UHFFFAOYSA-N
MW330.38 g/mol
LogP1.05
Rot. Bonds7

About 2-[2-(diethylamino)-2-oxoethyl]sulfonyl-N-(4-fluorophenyl)acetamide

2-[2-(diethylamino)-2-oxoethyl]sulfonyl-N-(4-fluorophenyl)acetamide (PubChem CID 39076319) has the molecular formula C14H19FN2O4S and a molecular weight of 330.38 g/mol. Its IUPAC name is 2-[2-(diethylamino)-2-oxoethyl]sulfonyl-N-(4-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-[2-(diethylamino)-2-oxoethyl]sulfonyl-N-(4-fluorophenyl)acetamide
PubChem CID39076319
Molecular FormulaC14H19FN2O4S
Molecular Weight330.38 g/mol
Exact Mass330.10
IUPAC Name2-[2-(diethylamino)-2-oxoethyl]sulfonyl-N-(4-fluorophenyl)acetamide
SMILESCCN(CC)C(=O)CS(=O)(=O)CC(=O)Nc1ccc(F)cc1
InChIInChI=1S/C14H19FN2O4S/c1-3-17(4-2)14(19)10-22(20,21)9-13(18)16-12-7-5-11(15)6-8-12/h5-8H,3-4,9-10H2,1-2H3,(H,16,18)
InChIKeyMULQSOXFZLSOMC-UHFFFAOYSA-N
XLogP1.05
TPSA83.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.38
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[2-(diethylamino)-2-oxoethyl]sulfonyl-N-(4-fluorophenyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-fluorophenyl)-2-[2-(N-methylanilino)-2-oxoethyl]sulfonylacetamide
CID 39076339
N-(4-fluorophenyl)-2-[2-(4-fluorophenyl)-2-oxoethyl]sulfonylacetamide
CID 23409059
N-(4-ethylphenyl)-2-[2-(4-fluorophenyl)-2-oxoethyl]sulfonylacetamide
CID 23409064
N-(4-ethylphenyl)-2-[(4-fluorophenyl)methylsulfonyl]acetamide
CID 7731180
N-cyclopropyl-2-[2-(4-fluoroanilino)-2-oxoethyl]sulfonylacetamide
CID 39083672
2-[4-[2-(diethylamino)-2-oxoethyl]piperazine-1,4-diium-1-yl]-N-(4-fluorophenyl)acetamide
CID 8719175
N-benzyl-2-[2-(4-fluoroanilino)-2-oxoethyl]sulfonylacetamide
CID 39083624
N-(4-fluorophenyl)-2-(4-fluorophenyl)sulfonylacetamide
CID 7544878
2-(4-aminobutylsulfonyl)-N-(4-fluorophenyl)acetamide
CID 82180278
2-[2-[bis(2-methoxyethyl)amino]-2-oxoethyl]sulfonyl-N-phenylacetamide
CID 39076137
N-(4-fluorophenyl)-2-[methylsulfonyl(propyl)amino]acetamide
CID 113147567
2-[[amino(diethylamino)methylidene]amino]-N-(4-fluorophenyl)acetamide;hydroiodide
CID 111089290

Frequently Asked Questions

What is the IUPAC name of 2-[2-(diethylamino)-2-oxoethyl]sulfonyl-N-(4-fluorophenyl)acetamide?
The IUPAC name of 2-[2-(diethylamino)-2-oxoethyl]sulfonyl-N-(4-fluorophenyl)acetamide (CID 39076319) is 2-[2-(diethylamino)-2-oxoethyl]sulfonyl-N-(4-fluorophenyl)acetamide.
What is the SMILES notation for 2-[2-(diethylamino)-2-oxoethyl]sulfonyl-N-(4-fluorophenyl)acetamide?
The canonical SMILES for 2-[2-(diethylamino)-2-oxoethyl]sulfonyl-N-(4-fluorophenyl)acetamide is CCN(CC)C(=O)CS(=O)(=O)CC(=O)Nc1ccc(F)cc1.
What is the InChIKey of 2-[2-(diethylamino)-2-oxoethyl]sulfonyl-N-(4-fluorophenyl)acetamide?
The InChIKey is MULQSOXFZLSOMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O4S/c1-3-17(4-2)14(19)10-22(20,21)9-13(18)16-12-7-5-11(15)6-8-12/h5-8H,3-4,9-10H2,1-2H3,(H,16,18).
What are the key properties of 2-[2-(diethylamino)-2-oxoethyl]sulfonyl-N-(4-fluorophenyl)acetamide?
2-[2-(diethylamino)-2-oxoethyl]sulfonyl-N-(4-fluorophenyl)acetamide has a molecular weight of 330.38 g/mol, XLogP of 1.05, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(diethylamino)-2-oxoethyl]sulfonyl-N-(4-fluorophenyl)acetamide is sourced from PubChem (CID 39076319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).