2-(2-amino-4-bromophenoxy)-N-(4-bromophenyl)acetamide

C14H12Br2N2O2 — CID 65430170

IUPAC2-(2-amino-4-bromophenoxy)-N-(4-bromophenyl)acetamide
SMILESNc1cc(Br)ccc1OCC(=O)Nc1ccc(Br)cc1
InChIInChI=1S/C14H12Br2N2O2/c15-9-1-4-11(5-2-9)18-14(19)8-20-13-6-3-10(16)7-12(13)17/h1-7H,8,17H2,(H,18,19)
InChIKeyRJOIXOICZXFLJE-UHFFFAOYSA-N
MW400.07 g/mol
LogP3.81
Rot. Bonds4

About 2-(2-amino-4-bromophenoxy)-N-(4-bromophenyl)acetamide

2-(2-amino-4-bromophenoxy)-N-(4-bromophenyl)acetamide (PubChem CID 65430170) has the molecular formula C14H12Br2N2O2 and a molecular weight of 400.07 g/mol. Its IUPAC name is 2-(2-amino-4-bromophenoxy)-N-(4-bromophenyl)acetamide.

Molecular Properties

Compound Name2-(2-amino-4-bromophenoxy)-N-(4-bromophenyl)acetamide
PubChem CID65430170
Molecular FormulaC14H12Br2N2O2
Molecular Weight400.07 g/mol
Exact Mass397.93
IUPAC Name2-(2-amino-4-bromophenoxy)-N-(4-bromophenyl)acetamide
SMILESNc1cc(Br)ccc1OCC(=O)Nc1ccc(Br)cc1
InChIInChI=1S/C14H12Br2N2O2/c15-9-1-4-11(5-2-9)18-14(19)8-20-13-6-3-10(16)7-12(13)17/h1-7H,8,17H2,(H,18,19)
InChIKeyRJOIXOICZXFLJE-UHFFFAOYSA-N
XLogP3.81
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.07
LogP ≤ 53.81
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-bromophenyl)acetamide
CID 103482897
2-(2-amino-4-bromophenoxy)-N-ethylacetamide
CID 65430348
2-(2-amino-4-bromophenoxy)-N-(cyclopropylmethyl)acetamide
CID 65430722
2-(4-bromo-2-methylphenoxy)-N-[4-[[4-[[2-(4-bromo-2-methylphenoxy)acetyl]amino]phenyl]methyl]phenyl]acetamide
CID 5180817
2-(2-amino-4-bromophenoxy)-N-cycloheptylacetamide
CID 65430153
2-(2-amino-4-bromophenoxy)-N-benzylacetamide
CID 65429040
2-(4-bromo-2-cyanophenoxy)-N-(4-fluorophenyl)acetamide
CID 80611460
2-(5-bromo-2-fluorophenoxy)-N-(4-fluorophenyl)acetamide
CID 115918565
N-(4-bromophenyl)-2-(4-fluoro-2-formylphenoxy)acetamide
CID 107697645
2-(2,4-dibromophenoxy)-N-(4-propan-2-ylphenyl)acetamide
CID 2788023
2-[[2-(4-bromo-2-fluorophenoxy)acetyl]amino]-N-(4-bromophenyl)acetamide
CID 55879510
2-(2-amino-4-bromo-5-fluorophenoxy)-N-(4-fluorophenyl)acetamide
CID 103482895

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-4-bromophenoxy)-N-(4-bromophenyl)acetamide?
The IUPAC name of 2-(2-amino-4-bromophenoxy)-N-(4-bromophenyl)acetamide (CID 65430170) is 2-(2-amino-4-bromophenoxy)-N-(4-bromophenyl)acetamide.
What is the SMILES notation for 2-(2-amino-4-bromophenoxy)-N-(4-bromophenyl)acetamide?
The canonical SMILES for 2-(2-amino-4-bromophenoxy)-N-(4-bromophenyl)acetamide is Nc1cc(Br)ccc1OCC(=O)Nc1ccc(Br)cc1.
What is the InChIKey of 2-(2-amino-4-bromophenoxy)-N-(4-bromophenyl)acetamide?
The InChIKey is RJOIXOICZXFLJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Br2N2O2/c15-9-1-4-11(5-2-9)18-14(19)8-20-13-6-3-10(16)7-12(13)17/h1-7H,8,17H2,(H,18,19).
What are the key properties of 2-(2-amino-4-bromophenoxy)-N-(4-bromophenyl)acetamide?
2-(2-amino-4-bromophenoxy)-N-(4-bromophenyl)acetamide has a molecular weight of 400.07 g/mol, XLogP of 3.81, 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-bromophenoxy)-N-(4-bromophenyl)acetamide is sourced from PubChem (CID 65430170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).