N-[2-(4-ethylsulfonylphenyl)ethyl]-2-(3-methylphenyl)acetamide

C19H23NO3S — CID 110790716

IUPACN-[2-(4-ethylsulfonylphenyl)ethyl]-2-(3-methylphenyl)acetamide
SMILESCCS(=O)(=O)c1ccc(CCNC(=O)Cc2cccc(C)c2)cc1
InChIInChI=1S/C19H23NO3S/c1-3-24(22,23)18-9-7-16(8-10-18)11-12-20-19(21)14-17-6-4-5-15(2)13-17/h4-10,13H,3,11-12,14H2,1-2H3,(H,20,21)
InChIKeyFMPXUOKVWNVRAU-UHFFFAOYSA-N
MW345.46 g/mol
LogP2.69
Rot. Bonds7

About N-[2-(4-ethylsulfonylphenyl)ethyl]-2-(3-methylphenyl)acetamide

N-[2-(4-ethylsulfonylphenyl)ethyl]-2-(3-methylphenyl)acetamide (PubChem CID 110790716) has the molecular formula C19H23NO3S and a molecular weight of 345.46 g/mol. Its IUPAC name is N-[2-(4-ethylsulfonylphenyl)ethyl]-2-(3-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[2-(4-ethylsulfonylphenyl)ethyl]-2-(3-methylphenyl)acetamide
PubChem CID110790716
Molecular FormulaC19H23NO3S
Molecular Weight345.46 g/mol
Exact Mass345.14
IUPAC NameN-[2-(4-ethylsulfonylphenyl)ethyl]-2-(3-methylphenyl)acetamide
SMILESCCS(=O)(=O)c1ccc(CCNC(=O)Cc2cccc(C)c2)cc1
InChIInChI=1S/C19H23NO3S/c1-3-24(22,23)18-9-7-16(8-10-18)11-12-20-19(21)14-17-6-4-5-15(2)13-17/h4-10,13H,3,11-12,14H2,1-2H3,(H,20,21)
InChIKeyFMPXUOKVWNVRAU-UHFFFAOYSA-N
XLogP2.69
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.46
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(4-fluorophenyl)ethyl]-2-(3-methylphenyl)acetamide
CID 6468714
4-[2-[[2-(3-ethylsulfonylphenyl)acetyl]amino]ethyl]benzoic acid
CID 120513010
N-[2-(4-ethylsulfonylphenyl)ethyl]-2-(2-fluorophenyl)acetamide
CID 110790718
N-[2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl]-2-(3-methylphenyl)acetamide
CID 112993407
3-methyl-N-[2-(4-methylsulfonylphenyl)ethyl]benzamide
CID 110790612
N'-[(3-methylphenyl)methyl]-N-[2-(4-sulfamoylphenyl)ethyl]oxamide
CID 108984696
2-(3-methylphenyl)-N-(3-sulfamoylpropyl)acetamide
CID 62388737
2-(3-methylphenoxy)-N-[2-(4-methylsulfonylphenyl)ethyl]acetamide
CID 110790654
3-acetamido-N-[2-(3-methylphenyl)ethyl]propanamide
CID 110354308
N-[2-(diethylamino)ethyl]-2-(3-methylphenyl)acetamide
CID 17144542
3-methyl-N-[2-[4-[(3-methylbenzoyl)sulfamoyl]phenyl]ethyl]benzamide
CID 3438717
2-(3-methylphenoxy)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
CID 40613651

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-ethylsulfonylphenyl)ethyl]-2-(3-methylphenyl)acetamide?
The IUPAC name of N-[2-(4-ethylsulfonylphenyl)ethyl]-2-(3-methylphenyl)acetamide (CID 110790716) is N-[2-(4-ethylsulfonylphenyl)ethyl]-2-(3-methylphenyl)acetamide.
What is the SMILES notation for N-[2-(4-ethylsulfonylphenyl)ethyl]-2-(3-methylphenyl)acetamide?
The canonical SMILES for N-[2-(4-ethylsulfonylphenyl)ethyl]-2-(3-methylphenyl)acetamide is CCS(=O)(=O)c1ccc(CCNC(=O)Cc2cccc(C)c2)cc1.
What is the InChIKey of N-[2-(4-ethylsulfonylphenyl)ethyl]-2-(3-methylphenyl)acetamide?
The InChIKey is FMPXUOKVWNVRAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3S/c1-3-24(22,23)18-9-7-16(8-10-18)11-12-20-19(21)14-17-6-4-5-15(2)13-17/h4-10,13H,3,11-12,14H2,1-2H3,(H,20,21).
What are the key properties of N-[2-(4-ethylsulfonylphenyl)ethyl]-2-(3-methylphenyl)acetamide?
N-[2-(4-ethylsulfonylphenyl)ethyl]-2-(3-methylphenyl)acetamide has a molecular weight of 345.46 g/mol, XLogP of 2.69, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-ethylsulfonylphenyl)ethyl]-2-(3-methylphenyl)acetamide is sourced from PubChem (CID 110790716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).