(2R)-2-(2,4-dichlorophenoxy)-N-(3-ethylphenyl)propanamide

C17H17Cl2NO2 — CID 874427

IUPAC(2R)-2-(2,4-dichlorophenoxy)-N-(3-ethylphenyl)propanamide
SMILESCCc1cccc(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2Cl)c1
InChIInChI=1S/C17H17Cl2NO2/c1-3-12-5-4-6-14(9-12)20-17(21)11(2)22-16-8-7-13(18)10-15(16)19/h4-11H,3H2,1-2H3,(H,20,21)/t11-/m1/s1
InChIKeyATYCCOLSGSBFIZ-LLVKDONJSA-N
MW338.23 g/mol
LogP4.96
Rot. Bonds5

About (2R)-2-(2,4-dichlorophenoxy)-N-(3-ethylphenyl)propanamide

(2R)-2-(2,4-dichlorophenoxy)-N-(3-ethylphenyl)propanamide (PubChem CID 874427) has the molecular formula C17H17Cl2NO2 and a molecular weight of 338.23 g/mol. Its IUPAC name is (2R)-2-(2,4-dichlorophenoxy)-N-(3-ethylphenyl)propanamide.

Molecular Properties

Compound Name(2R)-2-(2,4-dichlorophenoxy)-N-(3-ethylphenyl)propanamide
PubChem CID874427
Molecular FormulaC17H17Cl2NO2
Molecular Weight338.23 g/mol
Exact Mass337.06
IUPAC Name(2R)-2-(2,4-dichlorophenoxy)-N-(3-ethylphenyl)propanamide
SMILESCCc1cccc(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2Cl)c1
InChIInChI=1S/C17H17Cl2NO2/c1-3-12-5-4-6-14(9-12)20-17(21)11(2)22-16-8-7-13(18)10-15(16)19/h4-11H,3H2,1-2H3,(H,20,21)/t11-/m1/s1
InChIKeyATYCCOLSGSBFIZ-LLVKDONJSA-N
XLogP4.96
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.23
LogP ≤ 54.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-(2,4-dichlorophenoxy)-N-(3-methylphenyl)propanamide
CID 2164297
(2R)-2-(2,4-dichlorophenoxy)-N-(2-ethylphenyl)propanamide
CID 785428
3-[2-(2,4-dichlorophenoxy)propanoylamino]-N-propan-2-ylbenzamide
CID 17197387
(2R)-N-(4-acetamidophenyl)-2-(2,4-dichlorophenoxy)propanamide
CID 1010932
N-[4-[[(2S)-2-(2,4-dichlorophenoxy)propanoyl]amino]phenyl]-2-methylpropanamide
CID 1293450
[(2S)-1-(4-ethylanilino)-1-oxopropan-2-yl] (2R)-2-(2,4-dichlorophenoxy)propanoate
CID 7872819
2-(2,4-dichlorophenoxy)-N-[2-(4-ethylphenyl)benzotriazol-5-yl]propanamide
CID 5032493
(2R)-2-(2,4-dichlorophenoxy)-N-naphthalen-2-ylpropanamide
CID 7723467
(2S)-2-(2,4-dichlorophenoxy)-N-(3,4-dimethylphenyl)propanamide
CID 909534
(2R)-2-(2,4-dichlorophenoxy)-N-(4-propan-2-ylphenyl)propanamide
CID 1335441
(2R)-2-(4-chloro-2-methylphenoxy)-N-(3-chlorophenyl)propanamide
CID 874173
N-(2,4-dichlorophenyl)-2-(3-ethylphenoxy)propanamide
CID 53267195

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2,4-dichlorophenoxy)-N-(3-ethylphenyl)propanamide?
The IUPAC name of (2R)-2-(2,4-dichlorophenoxy)-N-(3-ethylphenyl)propanamide (CID 874427) is (2R)-2-(2,4-dichlorophenoxy)-N-(3-ethylphenyl)propanamide.
What is the SMILES notation for (2R)-2-(2,4-dichlorophenoxy)-N-(3-ethylphenyl)propanamide?
The canonical SMILES for (2R)-2-(2,4-dichlorophenoxy)-N-(3-ethylphenyl)propanamide is CCc1cccc(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2Cl)c1.
What is the InChIKey of (2R)-2-(2,4-dichlorophenoxy)-N-(3-ethylphenyl)propanamide?
The InChIKey is ATYCCOLSGSBFIZ-LLVKDONJSA-N. The full InChI is InChI=1S/C17H17Cl2NO2/c1-3-12-5-4-6-14(9-12)20-17(21)11(2)22-16-8-7-13(18)10-15(16)19/h4-11H,3H2,1-2H3,(H,20,21)/t11-/m1/s1.
What are the key properties of (2R)-2-(2,4-dichlorophenoxy)-N-(3-ethylphenyl)propanamide?
(2R)-2-(2,4-dichlorophenoxy)-N-(3-ethylphenyl)propanamide has a molecular weight of 338.23 g/mol, XLogP of 4.96, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2,4-dichlorophenoxy)-N-(3-ethylphenyl)propanamide is sourced from PubChem (CID 874427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).