2-(2-amino-6-bromo-4-fluorophenoxy)-N-(3-chlorophenyl)acetamide

C14H11BrClFN2O2 — CID 43379337

IUPAC2-(2-amino-6-bromo-4-fluorophenoxy)-N-(3-chlorophenyl)acetamide
SMILESNc1cc(F)cc(Br)c1OCC(=O)Nc1cccc(Cl)c1
InChIInChI=1S/C14H11BrClFN2O2/c15-11-5-9(17)6-12(18)14(11)21-7-13(20)19-10-3-1-2-8(16)4-10/h1-6H,7,18H2,(H,19,20)
InChIKeyJRGIOZUHKSIOOW-UHFFFAOYSA-N
MW373.61 g/mol
LogP3.84
Rot. Bonds4

About 2-(2-amino-6-bromo-4-fluorophenoxy)-N-(3-chlorophenyl)acetamide

2-(2-amino-6-bromo-4-fluorophenoxy)-N-(3-chlorophenyl)acetamide (PubChem CID 43379337) has the molecular formula C14H11BrClFN2O2 and a molecular weight of 373.61 g/mol. Its IUPAC name is 2-(2-amino-6-bromo-4-fluorophenoxy)-N-(3-chlorophenyl)acetamide.

Molecular Properties

Compound Name2-(2-amino-6-bromo-4-fluorophenoxy)-N-(3-chlorophenyl)acetamide
PubChem CID43379337
Molecular FormulaC14H11BrClFN2O2
Molecular Weight373.61 g/mol
Exact Mass371.97
IUPAC Name2-(2-amino-6-bromo-4-fluorophenoxy)-N-(3-chlorophenyl)acetamide
SMILESNc1cc(F)cc(Br)c1OCC(=O)Nc1cccc(Cl)c1
InChIInChI=1S/C14H11BrClFN2O2/c15-11-5-9(17)6-12(18)14(11)21-7-13(20)19-10-3-1-2-8(16)4-10/h1-6H,7,18H2,(H,19,20)
InChIKeyJRGIOZUHKSIOOW-UHFFFAOYSA-N
XLogP3.84
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.61
LogP ≤ 53.84
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-6-bromo-4-fluorophenoxy)-N-(3-fluorophenyl)acetamide
CID 43379340
2-(2-amino-4,6-dimethylphenoxy)-N-(3-chlorophenyl)acetamide
CID 62056523
N-(4-amino-3-bromophenyl)-2-(3-chlorophenoxy)acetamide
CID 82862294
N-(3-chlorophenyl)-2-(2,4-difluorophenoxy)acetamide
CID 17173171
N-(2-amino-5-chlorophenyl)-2-(2,6-dibromophenoxy)acetamide
CID 29050775
2-(2-amino-4-methylphenoxy)-N-(3-chlorophenyl)acetamide
CID 61313800
N-(3-chlorophenyl)-2-naphthalen-1-yloxyacetamide
CID 954547
[2-(3-chloroanilino)-2-oxoethyl] 2,6-difluorobenzoate
CID 2515596
[2-(3-chloroanilino)-2-oxoethyl] 2-(4-fluorophenyl)acetate
CID 7759274
[2-(3-chloroanilino)-2-oxoethyl] 2-(2,6-dimethylphenoxy)acetate
CID 8528048
[2-(3-chloroanilino)-2-oxoethyl] 2,5-difluorobenzoate
CID 46925028
N-(3-bromophenyl)-2-(2,3,4,5,6-pentachlorophenoxy)acetamide
CID 19178145

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-6-bromo-4-fluorophenoxy)-N-(3-chlorophenyl)acetamide?
The IUPAC name of 2-(2-amino-6-bromo-4-fluorophenoxy)-N-(3-chlorophenyl)acetamide (CID 43379337) is 2-(2-amino-6-bromo-4-fluorophenoxy)-N-(3-chlorophenyl)acetamide.
What is the SMILES notation for 2-(2-amino-6-bromo-4-fluorophenoxy)-N-(3-chlorophenyl)acetamide?
The canonical SMILES for 2-(2-amino-6-bromo-4-fluorophenoxy)-N-(3-chlorophenyl)acetamide is Nc1cc(F)cc(Br)c1OCC(=O)Nc1cccc(Cl)c1.
What is the InChIKey of 2-(2-amino-6-bromo-4-fluorophenoxy)-N-(3-chlorophenyl)acetamide?
The InChIKey is JRGIOZUHKSIOOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrClFN2O2/c15-11-5-9(17)6-12(18)14(11)21-7-13(20)19-10-3-1-2-8(16)4-10/h1-6H,7,18H2,(H,19,20).
What are the key properties of 2-(2-amino-6-bromo-4-fluorophenoxy)-N-(3-chlorophenyl)acetamide?
2-(2-amino-6-bromo-4-fluorophenoxy)-N-(3-chlorophenyl)acetamide has a molecular weight of 373.61 g/mol, XLogP of 3.84, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-6-bromo-4-fluorophenoxy)-N-(3-chlorophenyl)acetamide is sourced from PubChem (CID 43379337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).