N-[4-(2-ethylsulfonylphenoxy)phenyl]-2-(2-methoxyethylamino)acetamide

C19H24N2O5S — CID 119813191

IUPACN-[4-(2-ethylsulfonylphenoxy)phenyl]-2-(2-methoxyethylamino)acetamide
SMILESCCS(=O)(=O)c1ccccc1Oc1ccc(NC(=O)CNCCOC)cc1
InChIInChI=1S/C19H24N2O5S/c1-3-27(23,24)18-7-5-4-6-17(18)26-16-10-8-15(9-11-16)21-19(22)14-20-12-13-25-2/h4-11,20H,3,12-14H2,1-2H3,(H,21,22)
InChIKeyUOUACCHMFOVVPX-UHFFFAOYSA-N
MW392.48 g/mol
LogP2.45
Rot. Bonds10

About N-[4-(2-ethylsulfonylphenoxy)phenyl]-2-(2-methoxyethylamino)acetamide

N-[4-(2-ethylsulfonylphenoxy)phenyl]-2-(2-methoxyethylamino)acetamide (PubChem CID 119813191) has the molecular formula C19H24N2O5S and a molecular weight of 392.48 g/mol. Its IUPAC name is N-[4-(2-ethylsulfonylphenoxy)phenyl]-2-(2-methoxyethylamino)acetamide.

Molecular Properties

Compound NameN-[4-(2-ethylsulfonylphenoxy)phenyl]-2-(2-methoxyethylamino)acetamide
PubChem CID119813191
Molecular FormulaC19H24N2O5S
Molecular Weight392.48 g/mol
Exact Mass392.14
IUPAC NameN-[4-(2-ethylsulfonylphenoxy)phenyl]-2-(2-methoxyethylamino)acetamide
SMILESCCS(=O)(=O)c1ccccc1Oc1ccc(NC(=O)CNCCOC)cc1
InChIInChI=1S/C19H24N2O5S/c1-3-27(23,24)18-7-5-4-6-17(18)26-16-10-8-15(9-11-16)21-19(22)14-20-12-13-25-2/h4-11,20H,3,12-14H2,1-2H3,(H,21,22)
InChIKeyUOUACCHMFOVVPX-UHFFFAOYSA-N
XLogP2.45
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.48
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(2-methoxyethylamino)-N-(4-methoxyphenyl)acetamide
CID 28565585
N-[4-(3,5-dimethylphenoxy)phenyl]-2-(2-methoxyethylamino)acetamide
CID 119741341
2-(2-methoxyethylamino)-N-[4-(3-methylsulfonylphenoxy)phenyl]acetamide
CID 119797567
N-[4-(ethylsulfonylamino)phenyl]-2-(2-methoxyethylamino)acetamide
CID 79272393
N-[4-(2-ethylsulfonylphenoxy)phenyl]-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119813180
N-(4-phenoxyphenyl)-2-(propylamino)acetamide
CID 54818609
2-(2-methoxyethylamino)-N-[4-(propylsulfonylamino)phenyl]acetamide;hydrochloride
CID 119754250
2-(2-methoxyethylamino)-N-[[4-(2-methoxyphenoxy)phenyl]methyl]acetamide
CID 119780942
N-(4-iodophenyl)-2-(2-methoxyethylamino)acetamide
CID 54819702
2-amino-N-[4-(2-ethylsulfonylphenoxy)phenyl]pentanamide;hydrochloride
CID 119340507
2-(2-methoxyethylamino)-N-[[4-(2-methoxyphenoxy)phenyl]methyl]acetamide;hydrochloride
CID 119780941
N-[4-[(2-chlorophenyl)methoxy]phenyl]-2-(2-methoxyethylamino)acetamide
CID 119738642

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-ethylsulfonylphenoxy)phenyl]-2-(2-methoxyethylamino)acetamide?
The IUPAC name of N-[4-(2-ethylsulfonylphenoxy)phenyl]-2-(2-methoxyethylamino)acetamide (CID 119813191) is N-[4-(2-ethylsulfonylphenoxy)phenyl]-2-(2-methoxyethylamino)acetamide.
What is the SMILES notation for N-[4-(2-ethylsulfonylphenoxy)phenyl]-2-(2-methoxyethylamino)acetamide?
The canonical SMILES for N-[4-(2-ethylsulfonylphenoxy)phenyl]-2-(2-methoxyethylamino)acetamide is CCS(=O)(=O)c1ccccc1Oc1ccc(NC(=O)CNCCOC)cc1.
What is the InChIKey of N-[4-(2-ethylsulfonylphenoxy)phenyl]-2-(2-methoxyethylamino)acetamide?
The InChIKey is UOUACCHMFOVVPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O5S/c1-3-27(23,24)18-7-5-4-6-17(18)26-16-10-8-15(9-11-16)21-19(22)14-20-12-13-25-2/h4-11,20H,3,12-14H2,1-2H3,(H,21,22).
What are the key properties of N-[4-(2-ethylsulfonylphenoxy)phenyl]-2-(2-methoxyethylamino)acetamide?
N-[4-(2-ethylsulfonylphenoxy)phenyl]-2-(2-methoxyethylamino)acetamide has a molecular weight of 392.48 g/mol, XLogP of 2.45, 10 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-ethylsulfonylphenoxy)phenyl]-2-(2-methoxyethylamino)acetamide is sourced from PubChem (CID 119813191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).