N-(3-ethylphenyl)-2-[2-(4-methylphenyl)ethenylsulfonylamino]acetamide

C19H22N2O3S — CID 78785642

IUPACN-(3-ethylphenyl)-2-[2-(4-methylphenyl)ethenylsulfonylamino]acetamide
SMILESCCc1cccc(NC(=O)CNS(=O)(=O)C=Cc2ccc(C)cc2)c1
InChIInChI=1S/C19H22N2O3S/c1-3-16-5-4-6-18(13-16)21-19(22)14-20-25(23,24)12-11-17-9-7-15(2)8-10-17/h4-13,20H,3,14H2,1-2H3,(H,21,22)
InChIKeyVKMPRVJBNNYMHJ-UHFFFAOYSA-N
MW358.46 g/mol
LogP3.09
Rot. Bonds7

About N-(3-ethylphenyl)-2-[2-(4-methylphenyl)ethenylsulfonylamino]acetamide

N-(3-ethylphenyl)-2-[2-(4-methylphenyl)ethenylsulfonylamino]acetamide (PubChem CID 78785642) has the molecular formula C19H22N2O3S and a molecular weight of 358.46 g/mol. Its IUPAC name is N-(3-ethylphenyl)-2-[2-(4-methylphenyl)ethenylsulfonylamino]acetamide.

Molecular Properties

Compound NameN-(3-ethylphenyl)-2-[2-(4-methylphenyl)ethenylsulfonylamino]acetamide
PubChem CID78785642
Molecular FormulaC19H22N2O3S
Molecular Weight358.46 g/mol
Exact Mass358.14
IUPAC NameN-(3-ethylphenyl)-2-[2-(4-methylphenyl)ethenylsulfonylamino]acetamide
SMILESCCc1cccc(NC(=O)CNS(=O)(=O)C=Cc2ccc(C)cc2)c1
InChIInChI=1S/C19H22N2O3S/c1-3-16-5-4-6-18(13-16)21-19(22)14-20-25(23,24)12-11-17-9-7-15(2)8-10-17/h4-13,20H,3,14H2,1-2H3,(H,21,22)
InChIKeyVKMPRVJBNNYMHJ-UHFFFAOYSA-N
XLogP3.09
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.46
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-fluorophenyl)-2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetamide
CID 26579069
N-(3-ethylphenyl)-2-[[2-[(4-methylphenyl)sulfonylamino]acetyl]amino]acetamide
CID 24536492
N-(4-acetamido-3-chlorophenyl)-2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetamide
CID 41296798
N-(3-ethylphenyl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide
CID 27256502
2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]-N-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 37244507
3-[[2-(4-methylphenyl)ethenylsulfonylamino]methyl]benzenesulfonamide
CID 55906600
N-cyclohexyl-2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetamide
CID 26534933
N-[3-[[acetyl(ethyl)amino]methyl]phenyl]-3-[[(E)-2-phenylethenyl]sulfonylamino]propanamide
CID 38807911
2-(3-ethylphenoxy)ethyl 2-[[(E)-2-phenylethenyl]sulfonylamino]acetate
CID 55321942
2-chloro-N-(3-ethylphenyl)acetamide
CID 2384588
4-amino-N-[2-(3-ethylanilino)-2-oxoethyl]butanamide
CID 119312070
[2-(4-methylanilino)-2-oxoethyl] 3-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]propanoate
CID 9066471

Frequently Asked Questions

What is the IUPAC name of N-(3-ethylphenyl)-2-[2-(4-methylphenyl)ethenylsulfonylamino]acetamide?
The IUPAC name of N-(3-ethylphenyl)-2-[2-(4-methylphenyl)ethenylsulfonylamino]acetamide (CID 78785642) is N-(3-ethylphenyl)-2-[2-(4-methylphenyl)ethenylsulfonylamino]acetamide.
What is the SMILES notation for N-(3-ethylphenyl)-2-[2-(4-methylphenyl)ethenylsulfonylamino]acetamide?
The canonical SMILES for N-(3-ethylphenyl)-2-[2-(4-methylphenyl)ethenylsulfonylamino]acetamide is CCc1cccc(NC(=O)CNS(=O)(=O)C=Cc2ccc(C)cc2)c1.
What is the InChIKey of N-(3-ethylphenyl)-2-[2-(4-methylphenyl)ethenylsulfonylamino]acetamide?
The InChIKey is VKMPRVJBNNYMHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3S/c1-3-16-5-4-6-18(13-16)21-19(22)14-20-25(23,24)12-11-17-9-7-15(2)8-10-17/h4-13,20H,3,14H2,1-2H3,(H,21,22).
What are the key properties of N-(3-ethylphenyl)-2-[2-(4-methylphenyl)ethenylsulfonylamino]acetamide?
N-(3-ethylphenyl)-2-[2-(4-methylphenyl)ethenylsulfonylamino]acetamide has a molecular weight of 358.46 g/mol, XLogP of 3.09, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethylphenyl)-2-[2-(4-methylphenyl)ethenylsulfonylamino]acetamide is sourced from PubChem (CID 78785642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).