N-(3-fluorophenyl)-2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetamide

C17H17FN2O3S — CID 26579069

IUPACN-(3-fluorophenyl)-2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetamide
SMILESCc1ccc(/C=C/S(=O)(=O)NCC(=O)Nc2cccc(F)c2)cc1
InChIInChI=1S/C17H17FN2O3S/c1-13-5-7-14(8-6-13)9-10-24(22,23)19-12-17(21)20-16-4-2-3-15(18)11-16/h2-11,19H,12H2,1H3,(H,20,21)/b10-9+
InChIKeyLBLKRTDHSJJONG-MDZDMXLPSA-N
MW348.40 g/mol
LogP2.66
Rot. Bonds6

About N-(3-fluorophenyl)-2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetamide

N-(3-fluorophenyl)-2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetamide (PubChem CID 26579069) has the molecular formula C17H17FN2O3S and a molecular weight of 348.40 g/mol. Its IUPAC name is N-(3-fluorophenyl)-2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetamide
PubChem CID26579069
Molecular FormulaC17H17FN2O3S
Molecular Weight348.40 g/mol
Exact Mass348.09
IUPAC NameN-(3-fluorophenyl)-2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetamide
SMILESCc1ccc(/C=C/S(=O)(=O)NCC(=O)Nc2cccc(F)c2)cc1
InChIInChI=1S/C17H17FN2O3S/c1-13-5-7-14(8-6-13)9-10-24(22,23)19-12-17(21)20-16-4-2-3-15(18)11-16/h2-11,19H,12H2,1H3,(H,20,21)/b10-9+
InChIKeyLBLKRTDHSJJONG-MDZDMXLPSA-N
XLogP2.66
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.40
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-ethylphenyl)-2-[2-(4-methylphenyl)ethenylsulfonylamino]acetamide
CID 78785642
N-[2-(3-fluoroanilino)-2-oxoethyl]-N-methyl-3-[[(E)-2-phenylethenyl]sulfonylamino]propanamide
CID 9439731
2-[(2,4-dimethylphenyl)sulfonylamino]-N-(3-fluorophenyl)acetamide
CID 113000466
2-(benzenesulfonamido)-N-(3-fluorophenyl)acetamide
CID 891841
N-[2-(3-fluoroanilino)-2-oxoethyl]-2-(4-methylphenyl)acetamide
CID 49335487
[2-(2-chloro-4-fluoroanilino)-2-oxoethyl] 2-[2-(4-methylphenyl)ethenylsulfonylamino]acetate
CID 71954271
2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]-N-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 37244507
N-(3-fluorophenyl)-3-(4-methylanilino)propanamide
CID 109034497
N-(2-fluorophenyl)-2-[[(E)-2-phenylethenyl]sulfonylamino]acetamide
CID 42766043
N-(3-fluorophenyl)-4-(4-methylphenyl)-4-oxobutanamide
CID 26579364
2-[(2-bromophenyl)sulfonylamino]-N-(3-fluorophenyl)acetamide
CID 9412386
(E)-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]-2-(4-methylphenyl)ethenesulfonamide
CID 71796584

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetamide?
The IUPAC name of N-(3-fluorophenyl)-2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetamide (CID 26579069) is N-(3-fluorophenyl)-2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetamide.
What is the SMILES notation for N-(3-fluorophenyl)-2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetamide?
The canonical SMILES for N-(3-fluorophenyl)-2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetamide is Cc1ccc(/C=C/S(=O)(=O)NCC(=O)Nc2cccc(F)c2)cc1.
What is the InChIKey of N-(3-fluorophenyl)-2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetamide?
The InChIKey is LBLKRTDHSJJONG-MDZDMXLPSA-N. The full InChI is InChI=1S/C17H17FN2O3S/c1-13-5-7-14(8-6-13)9-10-24(22,23)19-12-17(21)20-16-4-2-3-15(18)11-16/h2-11,19H,12H2,1H3,(H,20,21)/b10-9+.
What are the key properties of N-(3-fluorophenyl)-2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetamide?
N-(3-fluorophenyl)-2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetamide has a molecular weight of 348.40 g/mol, XLogP of 2.66, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetamide is sourced from PubChem (CID 26579069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).