2-(2-chloro-4-fluorophenoxy)-N-(2,4-dichlorophenyl)propanamide

C15H11Cl3FNO2 — CID 112778697

IUPAC2-(2-chloro-4-fluorophenoxy)-N-(2,4-dichlorophenyl)propanamide
SMILESCC(Oc1ccc(F)cc1Cl)C(=O)Nc1ccc(Cl)cc1Cl
InChIInChI=1S/C15H11Cl3FNO2/c1-8(22-14-5-3-10(19)7-12(14)18)15(21)20-13-4-2-9(16)6-11(13)17/h2-8H,1H3,(H,20,21)
InChIKeyACIPBVRWRAWVOU-UHFFFAOYSA-N
MW362.62 g/mol
LogP5.19
Rot. Bonds4

About 2-(2-chloro-4-fluorophenoxy)-N-(2,4-dichlorophenyl)propanamide

2-(2-chloro-4-fluorophenoxy)-N-(2,4-dichlorophenyl)propanamide (PubChem CID 112778697) has the molecular formula C15H11Cl3FNO2 and a molecular weight of 362.62 g/mol. Its IUPAC name is 2-(2-chloro-4-fluorophenoxy)-N-(2,4-dichlorophenyl)propanamide.

Molecular Properties

Compound Name2-(2-chloro-4-fluorophenoxy)-N-(2,4-dichlorophenyl)propanamide
PubChem CID112778697
Molecular FormulaC15H11Cl3FNO2
Molecular Weight362.62 g/mol
Exact Mass360.98
IUPAC Name2-(2-chloro-4-fluorophenoxy)-N-(2,4-dichlorophenyl)propanamide
SMILESCC(Oc1ccc(F)cc1Cl)C(=O)Nc1ccc(Cl)cc1Cl
InChIInChI=1S/C15H11Cl3FNO2/c1-8(22-14-5-3-10(19)7-12(14)18)15(21)20-13-4-2-9(16)6-11(13)17/h2-8H,1H3,(H,20,21)
InChIKeyACIPBVRWRAWVOU-UHFFFAOYSA-N
XLogP5.19
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.62
LogP ≤ 55.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-amino-2-chlorophenyl)-2-(2,4-dichlorophenoxy)propanamide
CID 110209226
(2R)-N-(2,4-dichlorophenyl)-2-(2-fluorophenoxy)propanamide
CID 7815023
(2R)-2-(2,4-dichlorophenoxy)-N-(2,3,4-trifluorophenyl)propanamide
CID 2110698
(2R)-2-(2,4-dichlorophenoxy)-N-(2-fluorophenyl)propanamide
CID 881150
(2R)-N-(2-chloro-4-fluorophenyl)-2-(2-methoxyphenoxy)propanamide
CID 7834392
(2S)-N-(2-chloro-4-fluorophenyl)-2-(2-methoxyphenoxy)propanamide
CID 7834391
(2S)-2-(2-bromophenoxy)-N-(2-chloro-4-fluorophenyl)propanamide
CID 7707079
(2S)-N-(2-chloro-4-fluorophenyl)-2-(2,3,5,6-tetrafluorophenoxy)propanamide
CID 7467684
2-(2,4-dichlorophenoxy)-N-(2,3,4,5,6-pentafluorophenyl)propanamide
CID 4249290
2-(2,4-dichlorophenoxy)-N-(3-fluoro-2-methylphenyl)propanamide
CID 2916938
N-(2,4-dichlorophenyl)-2-(2,3,5-trimethylphenoxy)propanamide
CID 46770459
(2S)-N-(2-chloro-4-fluorophenyl)-2-(2-formylphenoxy)propanamide
CID 7762785

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-4-fluorophenoxy)-N-(2,4-dichlorophenyl)propanamide?
The IUPAC name of 2-(2-chloro-4-fluorophenoxy)-N-(2,4-dichlorophenyl)propanamide (CID 112778697) is 2-(2-chloro-4-fluorophenoxy)-N-(2,4-dichlorophenyl)propanamide.
What is the SMILES notation for 2-(2-chloro-4-fluorophenoxy)-N-(2,4-dichlorophenyl)propanamide?
The canonical SMILES for 2-(2-chloro-4-fluorophenoxy)-N-(2,4-dichlorophenyl)propanamide is CC(Oc1ccc(F)cc1Cl)C(=O)Nc1ccc(Cl)cc1Cl.
What is the InChIKey of 2-(2-chloro-4-fluorophenoxy)-N-(2,4-dichlorophenyl)propanamide?
The InChIKey is ACIPBVRWRAWVOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl3FNO2/c1-8(22-14-5-3-10(19)7-12(14)18)15(21)20-13-4-2-9(16)6-11(13)17/h2-8H,1H3,(H,20,21).
What are the key properties of 2-(2-chloro-4-fluorophenoxy)-N-(2,4-dichlorophenyl)propanamide?
2-(2-chloro-4-fluorophenoxy)-N-(2,4-dichlorophenyl)propanamide has a molecular weight of 362.62 g/mol, XLogP of 5.19, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-4-fluorophenoxy)-N-(2,4-dichlorophenyl)propanamide is sourced from PubChem (CID 112778697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).