N-(4-methoxyphenyl)-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide

C19H24N2O4S — CID 113060725

IUPACN-(4-methoxyphenyl)-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide
SMILESCOc1ccc(N(CCNS(=O)(=O)CCc2ccccc2)C(C)=O)cc1
InChIInChI=1S/C19H24N2O4S/c1-16(22)21(18-8-10-19(25-2)11-9-18)14-13-20-26(23,24)15-12-17-6-4-3-5-7-17/h3-11,20H,12-15H2,1-2H3
InChIKeyLQVCPTWXWMZRSY-UHFFFAOYSA-N
MW376.48 g/mol
LogP2.21
Rot. Bonds9

About N-(4-methoxyphenyl)-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide

N-(4-methoxyphenyl)-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide (PubChem CID 113060725) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide
PubChem CID113060725
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC NameN-(4-methoxyphenyl)-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide
SMILESCOc1ccc(N(CCNS(=O)(=O)CCc2ccccc2)C(C)=O)cc1
InChIInChI=1S/C19H24N2O4S/c1-16(22)21(18-8-10-19(25-2)11-9-18)14-13-20-26(23,24)15-12-17-6-4-3-5-7-17/h3-11,20H,12-15H2,1-2H3
InChIKeyLQVCPTWXWMZRSY-UHFFFAOYSA-N
XLogP2.21
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.48
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,6-dimethylphenyl)-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide
CID 113058169
N-[2-(2-phenylethylsulfonylamino)ethyl]-N-(2-propan-2-ylphenyl)acetamide
CID 113058668
N-[2-(2-phenylethylsulfonylamino)ethyl]-N-propylacetamide
CID 113051944
N-(3-chloro-2-methylphenyl)-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide
CID 113059789
N-[2-[(4-fluorophenyl)sulfonylamino]ethyl]-N-(4-methoxyphenyl)acetamide
CID 113060704
N-[2-(N-acetyl-4-methoxyanilino)ethyl]acetamide
CID 91715659
N-benzyl-N-[2-(3-phenylpropylsulfonylamino)ethyl]acetamide
CID 113054093
N-[2-(2-phenylethylsulfonylamino)ethyl]-N-prop-2-enylacetamide
CID 113052352
N-[2-(butylsulfonylamino)ethyl]-N-(3,4-dimethoxyphenyl)acetamide
CID 113061347
N-[(2-fluorophenyl)methyl]-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide
CID 113054620
N-[2-(ethylsulfonylamino)ethyl]-N-(4-propan-2-yloxyphenyl)acetamide
CID 113061132
N-[(2R)-2-hydroxy-2-phenylpropyl]-2-(4-methoxyphenyl)ethanesulfonamide
CID 95368060

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide?
The IUPAC name of N-(4-methoxyphenyl)-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide (CID 113060725) is N-(4-methoxyphenyl)-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide.
What is the SMILES notation for N-(4-methoxyphenyl)-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide?
The canonical SMILES for N-(4-methoxyphenyl)-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide is COc1ccc(N(CCNS(=O)(=O)CCc2ccccc2)C(C)=O)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide?
The InChIKey is LQVCPTWXWMZRSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-16(22)21(18-8-10-19(25-2)11-9-18)14-13-20-26(23,24)15-12-17-6-4-3-5-7-17/h3-11,20H,12-15H2,1-2H3.
What are the key properties of N-(4-methoxyphenyl)-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide?
N-(4-methoxyphenyl)-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide has a molecular weight of 376.48 g/mol, XLogP of 2.21, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide is sourced from PubChem (CID 113060725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).