2-(2-amino-4,5-dichlorophenoxy)-N-(4-fluorophenyl)acetamide

C14H11Cl2FN2O2 — CID 107498887

IUPAC2-(2-amino-4,5-dichlorophenoxy)-N-(4-fluorophenyl)acetamide
SMILESNc1cc(Cl)c(Cl)cc1OCC(=O)Nc1ccc(F)cc1
InChIInChI=1S/C14H11Cl2FN2O2/c15-10-5-12(18)13(6-11(10)16)21-7-14(20)19-9-3-1-8(17)2-4-9/h1-6H,7,18H2,(H,19,20)
InChIKeyWAMKMRIODMNNPJ-UHFFFAOYSA-N
MW329.16 g/mol
LogP3.73
Rot. Bonds4

About 2-(2-amino-4,5-dichlorophenoxy)-N-(4-fluorophenyl)acetamide

2-(2-amino-4,5-dichlorophenoxy)-N-(4-fluorophenyl)acetamide (PubChem CID 107498887) has the molecular formula C14H11Cl2FN2O2 and a molecular weight of 329.16 g/mol. Its IUPAC name is 2-(2-amino-4,5-dichlorophenoxy)-N-(4-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(2-amino-4,5-dichlorophenoxy)-N-(4-fluorophenyl)acetamide
PubChem CID107498887
Molecular FormulaC14H11Cl2FN2O2
Molecular Weight329.16 g/mol
Exact Mass328.02
IUPAC Name2-(2-amino-4,5-dichlorophenoxy)-N-(4-fluorophenyl)acetamide
SMILESNc1cc(Cl)c(Cl)cc1OCC(=O)Nc1ccc(F)cc1
InChIInChI=1S/C14H11Cl2FN2O2/c15-10-5-12(18)13(6-11(10)16)21-7-14(20)19-9-3-1-8(17)2-4-9/h1-6H,7,18H2,(H,19,20)
InChIKeyWAMKMRIODMNNPJ-UHFFFAOYSA-N
XLogP3.73
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.16
LogP ≤ 53.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(2-amino-4-bromo-5-fluorophenoxy)-N-(4-fluorophenyl)acetamide
CID 103482895
2-(2-aminophenoxy)-N-(4-fluorophenyl)acetamide
CID 16789642
N-(4-aminophenyl)-2-(2,4,5-trichlorophenoxy)acetamide
CID 29274448
N-(3-amino-4-chlorophenyl)-2-(4-fluorophenoxy)acetamide
CID 16788443
2-(2,4-difluorophenoxy)-N-(4-fluorophenyl)acetamide
CID 580280
N-(3-amino-4-chlorophenyl)-2-(2-fluorophenoxy)acetamide
CID 16793498
2-[2-(4-fluoroanilino)-2-oxoethoxy]benzamide
CID 7283884
2-(2-chloro-4-fluorophenoxy)-N-(4-methylphenyl)acetamide
CID 9402450
2-(2-amino-4-bromo-5-fluorophenoxy)-N-(4-bromophenyl)acetamide
CID 103482897
2-[[2-(2,4-dichlorophenoxy)acetyl]amino]-N-(4-fluorophenyl)acetamide
CID 2500780
2-(4-bromo-2-cyanophenoxy)-N-(4-fluorophenyl)acetamide
CID 80611460
N-(4-fluorophenyl)-2-(2-iodophenoxy)acetamide
CID 38878179

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-4,5-dichlorophenoxy)-N-(4-fluorophenyl)acetamide?
The IUPAC name of 2-(2-amino-4,5-dichlorophenoxy)-N-(4-fluorophenyl)acetamide (CID 107498887) is 2-(2-amino-4,5-dichlorophenoxy)-N-(4-fluorophenyl)acetamide.
What is the SMILES notation for 2-(2-amino-4,5-dichlorophenoxy)-N-(4-fluorophenyl)acetamide?
The canonical SMILES for 2-(2-amino-4,5-dichlorophenoxy)-N-(4-fluorophenyl)acetamide is Nc1cc(Cl)c(Cl)cc1OCC(=O)Nc1ccc(F)cc1.
What is the InChIKey of 2-(2-amino-4,5-dichlorophenoxy)-N-(4-fluorophenyl)acetamide?
The InChIKey is WAMKMRIODMNNPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2FN2O2/c15-10-5-12(18)13(6-11(10)16)21-7-14(20)19-9-3-1-8(17)2-4-9/h1-6H,7,18H2,(H,19,20).
What are the key properties of 2-(2-amino-4,5-dichlorophenoxy)-N-(4-fluorophenyl)acetamide?
2-(2-amino-4,5-dichlorophenoxy)-N-(4-fluorophenyl)acetamide has a molecular weight of 329.16 g/mol, XLogP of 3.73, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-4,5-dichlorophenoxy)-N-(4-fluorophenyl)acetamide is sourced from PubChem (CID 107498887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).