N-(2-amino-4,6-dibromophenyl)-2-(3,4-dichlorophenyl)acetamide

C14H10Br2Cl2N2O — CID 63046307

IUPACN-(2-amino-4,6-dibromophenyl)-2-(3,4-dichlorophenyl)acetamide
SMILESNc1cc(Br)cc(Br)c1NC(=O)Cc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C14H10Br2Cl2N2O/c15-8-5-9(16)14(12(19)6-8)20-13(21)4-7-1-2-10(17)11(18)3-7/h1-3,5-6H,4,19H2,(H,20,21)
InChIKeyQCESEYBWYHTTMC-UHFFFAOYSA-N
MW452.96 g/mol
LogP5.28
Rot. Bonds3

About N-(2-amino-4,6-dibromophenyl)-2-(3,4-dichlorophenyl)acetamide

N-(2-amino-4,6-dibromophenyl)-2-(3,4-dichlorophenyl)acetamide (PubChem CID 63046307) has the molecular formula C14H10Br2Cl2N2O and a molecular weight of 452.96 g/mol. Its IUPAC name is N-(2-amino-4,6-dibromophenyl)-2-(3,4-dichlorophenyl)acetamide.

Molecular Properties

Compound NameN-(2-amino-4,6-dibromophenyl)-2-(3,4-dichlorophenyl)acetamide
PubChem CID63046307
Molecular FormulaC14H10Br2Cl2N2O
Molecular Weight452.96 g/mol
Exact Mass449.85
IUPAC NameN-(2-amino-4,6-dibromophenyl)-2-(3,4-dichlorophenyl)acetamide
SMILESNc1cc(Br)cc(Br)c1NC(=O)Cc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C14H10Br2Cl2N2O/c15-8-5-9(16)14(12(19)6-8)20-13(21)4-7-1-2-10(17)11(18)3-7/h1-3,5-6H,4,19H2,(H,20,21)
InChIKeyQCESEYBWYHTTMC-UHFFFAOYSA-N
XLogP5.28
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500452.96
LogP ≤ 55.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-(2-amino-4,6-dibromophenyl)-2-(3,4-dichlorophenyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-amino-6-bromo-4-methylphenyl)-2-(3,4-dichlorophenyl)acetamide
CID 116813505
N-(2-amino-4,6-dibromophenyl)-2-(4-chlorophenyl)acetamide
CID 43548473
N-(2-amino-4,6-dibromophenyl)-2-(2-chlorophenyl)acetamide
CID 43548502
N-(4-bromo-2,6-difluorophenyl)-2-(3,4-dichlorophenyl)acetamide
CID 65498948
N-(4-bromophenyl)-2-(3,4-dichlorophenyl)acetamide
CID 2598783
N-(2-amino-4,6-dibromophenyl)-2-(2-chloro-6-fluorophenyl)acetamide
CID 43548456
N-(2-amino-4,6-dibromophenyl)-2-(2-hydroxyphenyl)acetamide
CID 80743929
N-(2-amino-4,6-dibromophenyl)-2-(2-methylphenyl)acetamide
CID 43548495
N-(2-amino-4-bromo-6-methylphenyl)-2-(4-bromophenyl)acetamide
CID 43550029
N-(2-amino-4,6-dibromophenyl)-2-(2,5-dimethylphenyl)acetamide
CID 62538988
N-(2-amino-4-chlorophenyl)-2-(3,4-dichlorophenyl)acetamide
CID 63045441
N-(2-aminophenyl)-2-(3,4-dichlorophenyl)acetamide
CID 63045267

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-4,6-dibromophenyl)-2-(3,4-dichlorophenyl)acetamide?
The IUPAC name of N-(2-amino-4,6-dibromophenyl)-2-(3,4-dichlorophenyl)acetamide (CID 63046307) is N-(2-amino-4,6-dibromophenyl)-2-(3,4-dichlorophenyl)acetamide.
What is the SMILES notation for N-(2-amino-4,6-dibromophenyl)-2-(3,4-dichlorophenyl)acetamide?
The canonical SMILES for N-(2-amino-4,6-dibromophenyl)-2-(3,4-dichlorophenyl)acetamide is Nc1cc(Br)cc(Br)c1NC(=O)Cc1ccc(Cl)c(Cl)c1.
What is the InChIKey of N-(2-amino-4,6-dibromophenyl)-2-(3,4-dichlorophenyl)acetamide?
The InChIKey is QCESEYBWYHTTMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Br2Cl2N2O/c15-8-5-9(16)14(12(19)6-8)20-13(21)4-7-1-2-10(17)11(18)3-7/h1-3,5-6H,4,19H2,(H,20,21).
What are the key properties of N-(2-amino-4,6-dibromophenyl)-2-(3,4-dichlorophenyl)acetamide?
N-(2-amino-4,6-dibromophenyl)-2-(3,4-dichlorophenyl)acetamide has a molecular weight of 452.96 g/mol, XLogP of 5.28, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-4,6-dibromophenyl)-2-(3,4-dichlorophenyl)acetamide is sourced from PubChem (CID 63046307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).