(2R)-2-(4-fluorophenoxy)-N-(2,4,5-trichlorophenyl)propanamide

C15H11Cl3FNO2 — CID 51642379

IUPAC(2R)-2-(4-fluorophenoxy)-N-(2,4,5-trichlorophenyl)propanamide
SMILESC[C@@H](Oc1ccc(F)cc1)C(=O)Nc1cc(Cl)c(Cl)cc1Cl
InChIInChI=1S/C15H11Cl3FNO2/c1-8(22-10-4-2-9(19)3-5-10)15(21)20-14-7-12(17)11(16)6-13(14)18/h2-8H,1H3,(H,20,21)/t8-/m1/s1
InChIKeyLYNICCCGMVWLGV-MRVPVSSYSA-N
MW362.62 g/mol
LogP5.19
Rot. Bonds4

About (2R)-2-(4-fluorophenoxy)-N-(2,4,5-trichlorophenyl)propanamide

(2R)-2-(4-fluorophenoxy)-N-(2,4,5-trichlorophenyl)propanamide (PubChem CID 51642379) has the molecular formula C15H11Cl3FNO2 and a molecular weight of 362.62 g/mol. Its IUPAC name is (2R)-2-(4-fluorophenoxy)-N-(2,4,5-trichlorophenyl)propanamide.

Molecular Properties

Compound Name(2R)-2-(4-fluorophenoxy)-N-(2,4,5-trichlorophenyl)propanamide
PubChem CID51642379
Molecular FormulaC15H11Cl3FNO2
Molecular Weight362.62 g/mol
Exact Mass360.98
IUPAC Name(2R)-2-(4-fluorophenoxy)-N-(2,4,5-trichlorophenyl)propanamide
SMILESC[C@@H](Oc1ccc(F)cc1)C(=O)Nc1cc(Cl)c(Cl)cc1Cl
InChIInChI=1S/C15H11Cl3FNO2/c1-8(22-10-4-2-9(19)3-5-10)15(21)20-14-7-12(17)11(16)6-13(14)18/h2-8H,1H3,(H,20,21)/t8-/m1/s1
InChIKeyLYNICCCGMVWLGV-MRVPVSSYSA-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

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

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Related Compounds

(2R)-2-(4-methylphenoxy)-N-(2,4,5-trichlorophenyl)propanamide
CID 7372209
(2R)-N-(3,4-dichlorophenyl)-2-(4-fluorophenoxy)propanamide
CID 40721189
(2S)-N-(4-chloro-2-fluorophenyl)-2-(4-fluorophenoxy)propanamide
CID 7961263
(2R)-2-(4-tert-butylphenoxy)-N-(2-chloro-4-fluorophenyl)propanamide
CID 7703445
(2S)-N-(5-fluoro-2-methylphenyl)-2-(4-fluorophenoxy)propanamide
CID 9097735
N-(4-amino-2-methylphenyl)-2-(4-fluorophenoxy)propanamide
CID 16786087
(2S)-N-(2-chloro-4-fluorophenyl)-2-(3,5-dimethoxyphenoxy)propanamide
CID 7713955
(2S)-N-(3-chloro-4-methylphenyl)-2-(4-fluorophenoxy)propanamide
CID 7734043
N-(3,5-dimethylphenyl)-2-(4-fluorophenoxy)propanamide
CID 21173898
N-(3-amino-4-chlorophenyl)-2-(4-fluorophenoxy)propanamide
CID 43081016
(2R)-2-(4-fluorophenoxy)-N-(2-methylphenyl)propanamide
CID 7946714
N-(4-bromo-2-fluorophenyl)-2-(4-fluorophenoxy)propanamide
CID 18084154

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-fluorophenoxy)-N-(2,4,5-trichlorophenyl)propanamide?
The IUPAC name of (2R)-2-(4-fluorophenoxy)-N-(2,4,5-trichlorophenyl)propanamide (CID 51642379) is (2R)-2-(4-fluorophenoxy)-N-(2,4,5-trichlorophenyl)propanamide.
What is the SMILES notation for (2R)-2-(4-fluorophenoxy)-N-(2,4,5-trichlorophenyl)propanamide?
The canonical SMILES for (2R)-2-(4-fluorophenoxy)-N-(2,4,5-trichlorophenyl)propanamide is C[C@@H](Oc1ccc(F)cc1)C(=O)Nc1cc(Cl)c(Cl)cc1Cl.
What is the InChIKey of (2R)-2-(4-fluorophenoxy)-N-(2,4,5-trichlorophenyl)propanamide?
The InChIKey is LYNICCCGMVWLGV-MRVPVSSYSA-N. The full InChI is InChI=1S/C15H11Cl3FNO2/c1-8(22-10-4-2-9(19)3-5-10)15(21)20-14-7-12(17)11(16)6-13(14)18/h2-8H,1H3,(H,20,21)/t8-/m1/s1.
What are the key properties of (2R)-2-(4-fluorophenoxy)-N-(2,4,5-trichlorophenyl)propanamide?
(2R)-2-(4-fluorophenoxy)-N-(2,4,5-trichlorophenyl)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 (2R)-2-(4-fluorophenoxy)-N-(2,4,5-trichlorophenyl)propanamide is sourced from PubChem (CID 51642379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).