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

C17H16Cl2FNO2 — CID 2937488

IUPAC2-(2,4-dichlorophenoxy)-N-[2-(4-fluorophenyl)ethyl]propanamide
SMILESCC(Oc1ccc(Cl)cc1Cl)C(=O)NCCc1ccc(F)cc1
InChIInChI=1S/C17H16Cl2FNO2/c1-11(23-16-7-4-13(18)10-15(16)19)17(22)21-9-8-12-2-5-14(20)6-3-12/h2-7,10-11H,8-9H2,1H3,(H,21,22)
InChIKeyVUJRBKQVWSOWBD-UHFFFAOYSA-N
MW356.22 g/mol
LogP4.26
Rot. Bonds6

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

2-(2,4-dichlorophenoxy)-N-[2-(4-fluorophenyl)ethyl]propanamide (PubChem CID 2937488) has the molecular formula C17H16Cl2FNO2 and a molecular weight of 356.22 g/mol. Its IUPAC name is 2-(2,4-dichlorophenoxy)-N-[2-(4-fluorophenyl)ethyl]propanamide.

Molecular Properties

Compound Name2-(2,4-dichlorophenoxy)-N-[2-(4-fluorophenyl)ethyl]propanamide
PubChem CID2937488
Molecular FormulaC17H16Cl2FNO2
Molecular Weight356.22 g/mol
Exact Mass355.05
IUPAC Name2-(2,4-dichlorophenoxy)-N-[2-(4-fluorophenyl)ethyl]propanamide
SMILESCC(Oc1ccc(Cl)cc1Cl)C(=O)NCCc1ccc(F)cc1
InChIInChI=1S/C17H16Cl2FNO2/c1-11(23-16-7-4-13(18)10-15(16)19)17(22)21-9-8-12-2-5-14(20)6-3-12/h2-7,10-11H,8-9H2,1H3,(H,21,22)
InChIKeyVUJRBKQVWSOWBD-UHFFFAOYSA-N
XLogP4.26
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.22
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-benzyl-2-(4-chlorophenoxy)acetamide
CID 2791617
N-benzyl-2-(2-chlorophenoxy)acetamide
CID 707236
2-(2,4-dichlorophenoxy)-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide
CID 2557714
2-(2-chlorophenoxy)-N-(1-phenylethyl)acetamide
CID 2787215
N-[2-(1-cyclohexen-1-yl)ethyl]-2-(2,4-dichlorophenoxy)propanamide
CID 2899212
N-(3-chlorobenzyl)-2-(2-chlorophenoxy)-N-((R)-pyrrolidin-2-ylmethyl)propanamide
CID 44579802
N-[2-(2-Chlorophenoxy)ethyl]-3-(4-methoxyphenyl)propanamide
CID 578621
Alanine, N-(2,4-dichloro-phenoxyacetyl)-3-phenyl-, DL-
CID 45074
N-[2-(1-cyclohexen-1-yl)ethyl]-2-(2,4-dichlorophenoxy)acetamide
CID 695016
2-(2-chlorophenoxy)-N-[2-(1-cyclohexen-1-yl)ethyl]acetamide
CID 833323
2-(4-chlorophenoxy)-N-[2-(1-cyclohexen-1-yl)ethyl]acetamide
CID 835819
2-(2,4-dichlorophenoxy)-N-(4-phenylbutyl)acetamide
CID 2218265

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenoxy)-N-[2-(4-fluorophenyl)ethyl]propanamide?
The IUPAC name of 2-(2,4-dichlorophenoxy)-N-[2-(4-fluorophenyl)ethyl]propanamide (CID 2937488) is 2-(2,4-dichlorophenoxy)-N-[2-(4-fluorophenyl)ethyl]propanamide.
What is the SMILES notation for 2-(2,4-dichlorophenoxy)-N-[2-(4-fluorophenyl)ethyl]propanamide?
The canonical SMILES for 2-(2,4-dichlorophenoxy)-N-[2-(4-fluorophenyl)ethyl]propanamide is CC(Oc1ccc(Cl)cc1Cl)C(=O)NCCc1ccc(F)cc1.
What is the InChIKey of 2-(2,4-dichlorophenoxy)-N-[2-(4-fluorophenyl)ethyl]propanamide?
The InChIKey is VUJRBKQVWSOWBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16Cl2FNO2/c1-11(23-16-7-4-13(18)10-15(16)19)17(22)21-9-8-12-2-5-14(20)6-3-12/h2-7,10-11H,8-9H2,1H3,(H,21,22).
What are the key properties of 2-(2,4-dichlorophenoxy)-N-[2-(4-fluorophenyl)ethyl]propanamide?
2-(2,4-dichlorophenoxy)-N-[2-(4-fluorophenyl)ethyl]propanamide has a molecular weight of 356.22 g/mol, XLogP of 4.26, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenoxy)-N-[2-(4-fluorophenyl)ethyl]propanamide is sourced from PubChem (CID 2937488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).