2-(2-amino-4-bromo-5-fluorophenoxy)-N-(4-bromophenyl)acetamide

C14H11Br2FN2O2 — CID 103482897

IUPAC2-(2-amino-4-bromo-5-fluorophenoxy)-N-(4-bromophenyl)acetamide
SMILESNc1cc(Br)c(F)cc1OCC(=O)Nc1ccc(Br)cc1
InChIInChI=1S/C14H11Br2FN2O2/c15-8-1-3-9(4-2-8)19-14(20)7-21-13-6-11(17)10(16)5-12(13)18/h1-6H,7,18H2,(H,19,20)
InChIKeyUQZKTSAAXLMTSZ-UHFFFAOYSA-N
MW418.06 g/mol
LogP3.95
Rot. Bonds4

About 2-(2-amino-4-bromo-5-fluorophenoxy)-N-(4-bromophenyl)acetamide

2-(2-amino-4-bromo-5-fluorophenoxy)-N-(4-bromophenyl)acetamide (PubChem CID 103482897) has the molecular formula C14H11Br2FN2O2 and a molecular weight of 418.06 g/mol. Its IUPAC name is 2-(2-amino-4-bromo-5-fluorophenoxy)-N-(4-bromophenyl)acetamide.

Molecular Properties

Compound Name2-(2-amino-4-bromo-5-fluorophenoxy)-N-(4-bromophenyl)acetamide
PubChem CID103482897
Molecular FormulaC14H11Br2FN2O2
Molecular Weight418.06 g/mol
Exact Mass415.92
IUPAC Name2-(2-amino-4-bromo-5-fluorophenoxy)-N-(4-bromophenyl)acetamide
SMILESNc1cc(Br)c(F)cc1OCC(=O)Nc1ccc(Br)cc1
InChIInChI=1S/C14H11Br2FN2O2/c15-8-1-3-9(4-2-8)19-14(20)7-21-13-6-11(17)10(16)5-12(13)18/h1-6H,7,18H2,(H,19,20)
InChIKeyUQZKTSAAXLMTSZ-UHFFFAOYSA-N
XLogP3.95
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.06
LogP ≤ 53.95
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-amino-4-bromophenoxy)-N-(4-bromophenyl)acetamide
CID 65430170
2-(5-bromo-2-fluorophenoxy)-N-(4-fluorophenyl)acetamide
CID 115918565
2-(2-amino-4,5-dichlorophenoxy)-N-(4-fluorophenyl)acetamide
CID 107498887
2-(5-bromo-2-methylphenoxy)-N-(4-fluorophenyl)acetamide
CID 107284225
2-(4-amino-2,5-difluorophenoxy)-N-(3-bromophenyl)acetamide
CID 63598293
2-(4-bromo-2-cyanophenoxy)-N-(4-fluorophenyl)acetamide
CID 80611460
2-[[2-(4-bromo-2-fluorophenoxy)acetyl]amino]-N-(4-bromophenyl)acetamide
CID 55879510
N-(4-bromophenyl)-2-(4-fluoro-2-formylphenoxy)acetamide
CID 107697645
2-(2,4-difluorophenoxy)-N-(4-fluorophenyl)acetamide
CID 580280
2-[2-(2-aminoethyl)phenoxy]-N-(4-bromophenyl)acetamide
CID 60905403
N-(4-aminophenyl)-2-(2-bromo-4-chlorophenoxy)acetamide
CID 29276938

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-4-bromo-5-fluorophenoxy)-N-(4-bromophenyl)acetamide?
The IUPAC name of 2-(2-amino-4-bromo-5-fluorophenoxy)-N-(4-bromophenyl)acetamide (CID 103482897) is 2-(2-amino-4-bromo-5-fluorophenoxy)-N-(4-bromophenyl)acetamide.
What is the SMILES notation for 2-(2-amino-4-bromo-5-fluorophenoxy)-N-(4-bromophenyl)acetamide?
The canonical SMILES for 2-(2-amino-4-bromo-5-fluorophenoxy)-N-(4-bromophenyl)acetamide is Nc1cc(Br)c(F)cc1OCC(=O)Nc1ccc(Br)cc1.
What is the InChIKey of 2-(2-amino-4-bromo-5-fluorophenoxy)-N-(4-bromophenyl)acetamide?
The InChIKey is UQZKTSAAXLMTSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Br2FN2O2/c15-8-1-3-9(4-2-8)19-14(20)7-21-13-6-11(17)10(16)5-12(13)18/h1-6H,7,18H2,(H,19,20).
What are the key properties of 2-(2-amino-4-bromo-5-fluorophenoxy)-N-(4-bromophenyl)acetamide?
2-(2-amino-4-bromo-5-fluorophenoxy)-N-(4-bromophenyl)acetamide has a molecular weight of 418.06 g/mol, XLogP of 3.95, 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-bromo-5-fluorophenoxy)-N-(4-bromophenyl)acetamide is sourced from PubChem (CID 103482897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).