2-(2,4-dichlorophenoxy)-N-(2-propoxyphenyl)propanamide

C18H19Cl2NO3 — CID 42997775

IUPAC2-(2,4-dichlorophenoxy)-N-(2-propoxyphenyl)propanamide
SMILESCCCOc1ccccc1NC(=O)C(C)Oc1ccc(Cl)cc1Cl
InChIInChI=1S/C18H19Cl2NO3/c1-3-10-23-17-7-5-4-6-15(17)21-18(22)12(2)24-16-9-8-13(19)11-14(16)20/h4-9,11-12H,3,10H2,1-2H3,(H,21,22)
InChIKeyNZRFCLUDEOXHKN-UHFFFAOYSA-N
MW368.26 g/mol
LogP5.19
Rot. Bonds7

About 2-(2,4-dichlorophenoxy)-N-(2-propoxyphenyl)propanamide

2-(2,4-dichlorophenoxy)-N-(2-propoxyphenyl)propanamide (PubChem CID 42997775) has the molecular formula C18H19Cl2NO3 and a molecular weight of 368.26 g/mol. Its IUPAC name is 2-(2,4-dichlorophenoxy)-N-(2-propoxyphenyl)propanamide.

Molecular Properties

Compound Name2-(2,4-dichlorophenoxy)-N-(2-propoxyphenyl)propanamide
PubChem CID42997775
Molecular FormulaC18H19Cl2NO3
Molecular Weight368.26 g/mol
Exact Mass367.07
IUPAC Name2-(2,4-dichlorophenoxy)-N-(2-propoxyphenyl)propanamide
SMILESCCCOc1ccccc1NC(=O)C(C)Oc1ccc(Cl)cc1Cl
InChIInChI=1S/C18H19Cl2NO3/c1-3-10-23-17-7-5-4-6-15(17)21-18(22)12(2)24-16-9-8-13(19)11-14(16)20/h4-9,11-12H,3,10H2,1-2H3,(H,21,22)
InChIKeyNZRFCLUDEOXHKN-UHFFFAOYSA-N
XLogP5.19
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.26
LogP ≤ 55.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-(2,4-dichlorophenoxy)-N-(2-ethylphenyl)propanamide
CID 785428
(2R)-2-(2,4-dichlorophenoxy)-N-(2-fluorophenyl)propanamide
CID 881150
N-(2-butoxyphenyl)-2-(4-chlorophenoxy)propanamide
CID 17087061
methyl 2-[2-(2,4-dichlorophenoxy)propanoylamino]benzoate
CID 2807434
2-[2-(2,4-dichlorophenoxy)propanoylamino]benzamide
CID 3579546
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
[(2S)-1-(2-methoxyanilino)-1-oxopropan-2-yl] (2S)-2-(2,4-dichlorophenoxy)propanoate
CID 7862498
(2R)-2-(2-chloro-4-nitrophenoxy)-N-(2-ethoxyphenyl)propanamide
CID 8956882
(2S)-2-(2,4-dichlorophenoxy)-N-pyrimidin-2-ylpropanamide
CID 672613
2-(2,4-dichlorophenoxy)-N-(3-fluoro-2-methylphenyl)propanamide
CID 2916938

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenoxy)-N-(2-propoxyphenyl)propanamide?
The IUPAC name of 2-(2,4-dichlorophenoxy)-N-(2-propoxyphenyl)propanamide (CID 42997775) is 2-(2,4-dichlorophenoxy)-N-(2-propoxyphenyl)propanamide.
What is the SMILES notation for 2-(2,4-dichlorophenoxy)-N-(2-propoxyphenyl)propanamide?
The canonical SMILES for 2-(2,4-dichlorophenoxy)-N-(2-propoxyphenyl)propanamide is CCCOc1ccccc1NC(=O)C(C)Oc1ccc(Cl)cc1Cl.
What is the InChIKey of 2-(2,4-dichlorophenoxy)-N-(2-propoxyphenyl)propanamide?
The InChIKey is NZRFCLUDEOXHKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19Cl2NO3/c1-3-10-23-17-7-5-4-6-15(17)21-18(22)12(2)24-16-9-8-13(19)11-14(16)20/h4-9,11-12H,3,10H2,1-2H3,(H,21,22).
What are the key properties of 2-(2,4-dichlorophenoxy)-N-(2-propoxyphenyl)propanamide?
2-(2,4-dichlorophenoxy)-N-(2-propoxyphenyl)propanamide has a molecular weight of 368.26 g/mol, XLogP of 5.19, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenoxy)-N-(2-propoxyphenyl)propanamide is sourced from PubChem (CID 42997775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).