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

C17H17Cl2NO2 — CID 785428

IUPAC(2R)-2-(2,4-dichlorophenoxy)-N-(2-ethylphenyl)propanamide
SMILESCCc1ccccc1NC(=O)[C@@H](C)Oc1ccc(Cl)cc1Cl
InChIInChI=1S/C17H17Cl2NO2/c1-3-12-6-4-5-7-15(12)20-17(21)11(2)22-16-9-8-13(18)10-14(16)19/h4-11H,3H2,1-2H3,(H,20,21)/t11-/m1/s1
InChIKeyXILUPFKISHRLCE-LLVKDONJSA-N
MW338.23 g/mol
LogP4.96
Rot. Bonds5

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

(2R)-2-(2,4-dichlorophenoxy)-N-(2-ethylphenyl)propanamide (PubChem CID 785428) has the molecular formula C17H17Cl2NO2 and a molecular weight of 338.23 g/mol. Its IUPAC name is (2R)-2-(2,4-dichlorophenoxy)-N-(2-ethylphenyl)propanamide.

Molecular Properties

Compound Name(2R)-2-(2,4-dichlorophenoxy)-N-(2-ethylphenyl)propanamide
PubChem CID785428
Molecular FormulaC17H17Cl2NO2
Molecular Weight338.23 g/mol
Exact Mass337.06
IUPAC Name(2R)-2-(2,4-dichlorophenoxy)-N-(2-ethylphenyl)propanamide
SMILESCCc1ccccc1NC(=O)[C@@H](C)Oc1ccc(Cl)cc1Cl
InChIInChI=1S/C17H17Cl2NO2/c1-3-12-6-4-5-7-15(12)20-17(21)11(2)22-16-9-8-13(18)10-14(16)19/h4-11H,3H2,1-2H3,(H,20,21)/t11-/m1/s1
InChIKeyXILUPFKISHRLCE-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-(2-fluorophenyl)propanamide
CID 881150
2-(2,4-dichlorophenoxy)-N-(2-propoxyphenyl)propanamide
CID 42997775
2-[2-(2,4-dichlorophenoxy)propanoylamino]benzamide
CID 3579546
methyl 2-[2-(2,4-dichlorophenoxy)propanoylamino]benzoate
CID 2807434
2-[[(2S)-2-(2,4-dichlorophenoxy)propanoyl]amino]benzamide
CID 1335501
(2S)-2-(2,4-dichlorophenoxy)-N-[2-(trifluoromethyl)phenyl]propanamide
CID 7720105
N-(3-acetamido-2-methylphenyl)-2-(2,4-dichlorophenoxy)propanamide
CID 134019274
2-(2,4-dichlorophenoxy)-N-(3-fluoro-2-methylphenyl)propanamide
CID 2916938
N-[4-[[(2S)-2-(2,4-dichlorophenoxy)propanoyl]amino]phenyl]-2-methylpropanamide
CID 1293450
(2R)-2-(2,4-dichlorophenoxy)-N-(3-ethylphenyl)propanamide
CID 874427
N-(4-amino-2-chlorophenyl)-2-(2,4-dichlorophenoxy)propanamide
CID 110209226
(2R)-2-(2,4-dichlorophenoxy)-N-(2,3,4-trifluorophenyl)propanamide
CID 2110698

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2,4-dichlorophenoxy)-N-(2-ethylphenyl)propanamide?
The IUPAC name of (2R)-2-(2,4-dichlorophenoxy)-N-(2-ethylphenyl)propanamide (CID 785428) is (2R)-2-(2,4-dichlorophenoxy)-N-(2-ethylphenyl)propanamide.
What is the SMILES notation for (2R)-2-(2,4-dichlorophenoxy)-N-(2-ethylphenyl)propanamide?
The canonical SMILES for (2R)-2-(2,4-dichlorophenoxy)-N-(2-ethylphenyl)propanamide is CCc1ccccc1NC(=O)[C@@H](C)Oc1ccc(Cl)cc1Cl.
What is the InChIKey of (2R)-2-(2,4-dichlorophenoxy)-N-(2-ethylphenyl)propanamide?
The InChIKey is XILUPFKISHRLCE-LLVKDONJSA-N. The full InChI is InChI=1S/C17H17Cl2NO2/c1-3-12-6-4-5-7-15(12)20-17(21)11(2)22-16-9-8-13(18)10-14(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-(2-ethylphenyl)propanamide?
(2R)-2-(2,4-dichlorophenoxy)-N-(2-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-(2-ethylphenyl)propanamide is sourced from PubChem (CID 785428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).