2-(2,4-dichlorophenoxy)-N-[2-(4-methoxyphenyl)ethyl]propanamide

C18H19Cl2NO3 — CID 3120270

IUPAC2-(2,4-dichlorophenoxy)-N-[2-(4-methoxyphenyl)ethyl]propanamide
SMILESCOc1ccc(CCNC(=O)C(C)Oc2ccc(Cl)cc2Cl)cc1
InChIInChI=1S/C18H19Cl2NO3/c1-12(24-17-8-5-14(19)11-16(17)20)18(22)21-10-9-13-3-6-15(23-2)7-4-13/h3-8,11-12H,9-10H2,1-2H3,(H,21,22)
InChIKeyJSZAEMKGHBNFJW-UHFFFAOYSA-N
MW368.26 g/mol
LogP4.13
Rot. Bonds7

About 2-(2,4-dichlorophenoxy)-N-[2-(4-methoxyphenyl)ethyl]propanamide

2-(2,4-dichlorophenoxy)-N-[2-(4-methoxyphenyl)ethyl]propanamide (PubChem CID 3120270) has the molecular formula C18H19Cl2NO3 and a molecular weight of 368.26 g/mol. Its IUPAC name is 2-(2,4-dichlorophenoxy)-N-[2-(4-methoxyphenyl)ethyl]propanamide.

Molecular Properties

Compound Name2-(2,4-dichlorophenoxy)-N-[2-(4-methoxyphenyl)ethyl]propanamide
PubChem CID3120270
Molecular FormulaC18H19Cl2NO3
Molecular Weight368.26 g/mol
Exact Mass367.07
IUPAC Name2-(2,4-dichlorophenoxy)-N-[2-(4-methoxyphenyl)ethyl]propanamide
SMILESCOc1ccc(CCNC(=O)C(C)Oc2ccc(Cl)cc2Cl)cc1
InChIInChI=1S/C18H19Cl2NO3/c1-12(24-17-8-5-14(19)11-16(17)20)18(22)21-10-9-13-3-6-15(23-2)7-4-13/h3-8,11-12H,9-10H2,1-2H3,(H,21,22)
InChIKeyJSZAEMKGHBNFJW-UHFFFAOYSA-N
XLogP4.13
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.26
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-(2,4-dichlorophenoxy)-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide
CID 2164093
(2R)-2-(2,4-dichlorophenoxy)-N-(4-methoxyphenyl)propanamide
CID 697237
(2R)-2-(4-chlorophenoxy)-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide
CID 51532938
1-[(2,4-dichlorophenoxy)methyl]-3-[2-(4-methoxyphenyl)ethyl]urea
CID 108880887
N'-[(2S)-2-(2,4-dichlorophenoxy)propanoyl]-4-methoxybenzohydrazide
CID 1104980
N-[2-(4-methoxyphenyl)ethyl]-2-(4-propan-2-ylphenoxy)propanamide
CID 24511975
(2R)-2-(4-chloro-2-methylphenoxy)-N-[2-(4-fluorophenyl)ethyl]propanamide
CID 8709012
4-[2-(2,4-dichlorophenoxy)propanoylamino]butanoic acid
CID 43239301
(2R)-2-(2,4-dichlorophenoxy)-N-[(2R)-2-hydroxypropyl]propanamide
CID 39950205
N-[2-(4-chlorophenyl)ethyl]-2-(2,4-dimethylphenoxy)propanamide
CID 133211038
(2S)-2-(3-chlorophenoxy)-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide
CID 7026894
2-(2,4-dichlorophenoxy)-N-dodecylpropanamide
CID 4582803

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenoxy)-N-[2-(4-methoxyphenyl)ethyl]propanamide?
The IUPAC name of 2-(2,4-dichlorophenoxy)-N-[2-(4-methoxyphenyl)ethyl]propanamide (CID 3120270) is 2-(2,4-dichlorophenoxy)-N-[2-(4-methoxyphenyl)ethyl]propanamide.
What is the SMILES notation for 2-(2,4-dichlorophenoxy)-N-[2-(4-methoxyphenyl)ethyl]propanamide?
The canonical SMILES for 2-(2,4-dichlorophenoxy)-N-[2-(4-methoxyphenyl)ethyl]propanamide is COc1ccc(CCNC(=O)C(C)Oc2ccc(Cl)cc2Cl)cc1.
What is the InChIKey of 2-(2,4-dichlorophenoxy)-N-[2-(4-methoxyphenyl)ethyl]propanamide?
The InChIKey is JSZAEMKGHBNFJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19Cl2NO3/c1-12(24-17-8-5-14(19)11-16(17)20)18(22)21-10-9-13-3-6-15(23-2)7-4-13/h3-8,11-12H,9-10H2,1-2H3,(H,21,22).
What are the key properties of 2-(2,4-dichlorophenoxy)-N-[2-(4-methoxyphenyl)ethyl]propanamide?
2-(2,4-dichlorophenoxy)-N-[2-(4-methoxyphenyl)ethyl]propanamide has a molecular weight of 368.26 g/mol, XLogP of 4.13, 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-(4-methoxyphenyl)ethyl]propanamide is sourced from PubChem (CID 3120270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).