(2R)-N-[4-(2-methylsulfonylethoxy)phenyl]-2-phenylpropanamide

C18H21NO4S — CID 126836479

IUPAC(2R)-N-[4-(2-methylsulfonylethoxy)phenyl]-2-phenylpropanamide
SMILESC[C@@H](C(=O)Nc1ccc(OCCS(C)(=O)=O)cc1)c1ccccc1
InChIInChI=1S/C18H21NO4S/c1-14(15-6-4-3-5-7-15)18(20)19-16-8-10-17(11-9-16)23-12-13-24(2,21)22/h3-11,14H,12-13H2,1-2H3,(H,19,20)/t14-/m1/s1
InChIKeyZGUZRTURYKKDNJ-CQSZACIVSA-N
MW347.44 g/mol
LogP2.85
Rot. Bonds7

About (2R)-N-[4-(2-methylsulfonylethoxy)phenyl]-2-phenylpropanamide

(2R)-N-[4-(2-methylsulfonylethoxy)phenyl]-2-phenylpropanamide (PubChem CID 126836479) has the molecular formula C18H21NO4S and a molecular weight of 347.44 g/mol. Its IUPAC name is (2R)-N-[4-(2-methylsulfonylethoxy)phenyl]-2-phenylpropanamide.

Molecular Properties

Compound Name(2R)-N-[4-(2-methylsulfonylethoxy)phenyl]-2-phenylpropanamide
PubChem CID126836479
Molecular FormulaC18H21NO4S
Molecular Weight347.44 g/mol
Exact Mass347.12
IUPAC Name(2R)-N-[4-(2-methylsulfonylethoxy)phenyl]-2-phenylpropanamide
SMILESC[C@@H](C(=O)Nc1ccc(OCCS(C)(=O)=O)cc1)c1ccccc1
InChIInChI=1S/C18H21NO4S/c1-14(15-6-4-3-5-7-15)18(20)19-16-8-10-17(11-9-16)23-12-13-24(2,21)22/h3-11,14H,12-13H2,1-2H3,(H,19,20)/t14-/m1/s1
InChIKeyZGUZRTURYKKDNJ-CQSZACIVSA-N
XLogP2.85
TPSA72.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.44
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2R)-N-[4-(2-methylsulfonylethoxy)phenyl]-2-phenylpropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[4-[[(2S)-2-phenylpropanoyl]amino]phenoxy]butanoic acid
CID 120688439
(1R)-1-[4-(2-methylsulfonylethoxy)phenyl]ethanol
CID 63364098
N-(4-fluorophenyl)-2-phenylpropanamide
CID 2940269
1-(2-methylsulfonylethoxy)-4-propan-2-ylbenzene
CID 64763839
2-[[4-(2-phenylpropanoylamino)phenyl]sulfonylamino]acetic acid
CID 22456362
(2S)-2-(6-methoxynaphthalen-2-yl)-N-[4-(2-phenylethoxy)phenyl]propanamide
CID 54790263
2-[methyl(methylsulfonyl)amino]-2-phenyl-N-(4-prop-2-enoxyphenyl)acetamide
CID 133187295
N-(4-formylphenyl)-2-phenylpropanamide
CID 87347129
N-(6-amino-3-pyridinyl)-2-phenylpropanamide
CID 114028846
2-(3-aminophenyl)-N-(4-methoxyphenyl)propanamide
CID 106590702
N-[4-(cyanomethyl)phenyl]-2-phenylpropanamide
CID 104916745
2-amino-3-methyl-N-[3-(2-methylsulfonylethoxy)phenyl]pentanamide
CID 119763991

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[4-(2-methylsulfonylethoxy)phenyl]-2-phenylpropanamide?
The IUPAC name of (2R)-N-[4-(2-methylsulfonylethoxy)phenyl]-2-phenylpropanamide (CID 126836479) is (2R)-N-[4-(2-methylsulfonylethoxy)phenyl]-2-phenylpropanamide.
What is the SMILES notation for (2R)-N-[4-(2-methylsulfonylethoxy)phenyl]-2-phenylpropanamide?
The canonical SMILES for (2R)-N-[4-(2-methylsulfonylethoxy)phenyl]-2-phenylpropanamide is C[C@@H](C(=O)Nc1ccc(OCCS(C)(=O)=O)cc1)c1ccccc1.
What is the InChIKey of (2R)-N-[4-(2-methylsulfonylethoxy)phenyl]-2-phenylpropanamide?
The InChIKey is ZGUZRTURYKKDNJ-CQSZACIVSA-N. The full InChI is InChI=1S/C18H21NO4S/c1-14(15-6-4-3-5-7-15)18(20)19-16-8-10-17(11-9-16)23-12-13-24(2,21)22/h3-11,14H,12-13H2,1-2H3,(H,19,20)/t14-/m1/s1.
What are the key properties of (2R)-N-[4-(2-methylsulfonylethoxy)phenyl]-2-phenylpropanamide?
(2R)-N-[4-(2-methylsulfonylethoxy)phenyl]-2-phenylpropanamide has a molecular weight of 347.44 g/mol, XLogP of 2.85, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[4-(2-methylsulfonylethoxy)phenyl]-2-phenylpropanamide is sourced from PubChem (CID 126836479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).