2-(2-amino-6-bromophenoxy)-N-(2-chlorophenyl)acetamide

C14H12BrClN2O2 — CID 81499243

IUPAC2-(2-amino-6-bromophenoxy)-N-(2-chlorophenyl)acetamide
SMILESNc1cccc(Br)c1OCC(=O)Nc1ccccc1Cl
InChIInChI=1S/C14H12BrClN2O2/c15-9-4-3-6-11(17)14(9)20-8-13(19)18-12-7-2-1-5-10(12)16/h1-7H,8,17H2,(H,18,19)
InChIKeyXDCRFCPGASHPST-UHFFFAOYSA-N
MW355.62 g/mol
LogP3.70
Rot. Bonds4

About 2-(2-amino-6-bromophenoxy)-N-(2-chlorophenyl)acetamide

2-(2-amino-6-bromophenoxy)-N-(2-chlorophenyl)acetamide (PubChem CID 81499243) has the molecular formula C14H12BrClN2O2 and a molecular weight of 355.62 g/mol. Its IUPAC name is 2-(2-amino-6-bromophenoxy)-N-(2-chlorophenyl)acetamide.

Molecular Properties

Compound Name2-(2-amino-6-bromophenoxy)-N-(2-chlorophenyl)acetamide
PubChem CID81499243
Molecular FormulaC14H12BrClN2O2
Molecular Weight355.62 g/mol
Exact Mass353.98
IUPAC Name2-(2-amino-6-bromophenoxy)-N-(2-chlorophenyl)acetamide
SMILESNc1cccc(Br)c1OCC(=O)Nc1ccccc1Cl
InChIInChI=1S/C14H12BrClN2O2/c15-9-4-3-6-11(17)14(9)20-8-13(19)18-12-7-2-1-5-10(12)16/h1-7H,8,17H2,(H,18,19)
InChIKeyXDCRFCPGASHPST-UHFFFAOYSA-N
XLogP3.70
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.62
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-(2-amino-6-bromophenoxy)-N-(2-chlorophenyl)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

2-(2-amino-6-chlorophenoxy)-N-(2-chlorophenyl)acetamide
CID 107715816
2-(2-amino-6-chlorophenoxy)-N-(2-methylphenyl)acetamide
CID 107716023
N-(2-amino-5-chlorophenyl)-2-(2,6-dibromophenoxy)acetamide
CID 29050775
2-(2-aminophenoxy)-N-(2-bromo-3-chlorophenyl)acetamide
CID 103477091
N-(2-bromophenyl)-2-[2-chloro-6-(hydroxymethyl)phenoxy]acetamide
CID 115956327
N-(2-aminophenyl)-2-(2,6-difluorophenoxy)acetamide
CID 81268833
N-(2-chlorophenyl)-2-(2,3,6-trimethylphenoxy)acetamide
CID 731196
[2-(2-bromoanilino)-2-oxoethyl] 2,6-dichlorobenzoate
CID 2396477
2-(1-bromonaphthalen-2-yl)oxy-N-(2-chlorophenyl)acetamide
CID 1010729
N-(5-amino-2-methylphenyl)-2-(2,6-dibromophenoxy)acetamide
CID 29295025
N-(2-chlorophenyl)-2-[2,6-dibromo-4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenoxy]acetamide
CID 126260821
2-(4-amino-2,5-difluorophenoxy)-N-(2-chlorophenyl)acetamide
CID 63598292

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-6-bromophenoxy)-N-(2-chlorophenyl)acetamide?
The IUPAC name of 2-(2-amino-6-bromophenoxy)-N-(2-chlorophenyl)acetamide (CID 81499243) is 2-(2-amino-6-bromophenoxy)-N-(2-chlorophenyl)acetamide.
What is the SMILES notation for 2-(2-amino-6-bromophenoxy)-N-(2-chlorophenyl)acetamide?
The canonical SMILES for 2-(2-amino-6-bromophenoxy)-N-(2-chlorophenyl)acetamide is Nc1cccc(Br)c1OCC(=O)Nc1ccccc1Cl.
What is the InChIKey of 2-(2-amino-6-bromophenoxy)-N-(2-chlorophenyl)acetamide?
The InChIKey is XDCRFCPGASHPST-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12BrClN2O2/c15-9-4-3-6-11(17)14(9)20-8-13(19)18-12-7-2-1-5-10(12)16/h1-7H,8,17H2,(H,18,19).
What are the key properties of 2-(2-amino-6-bromophenoxy)-N-(2-chlorophenyl)acetamide?
2-(2-amino-6-bromophenoxy)-N-(2-chlorophenyl)acetamide has a molecular weight of 355.62 g/mol, XLogP of 3.70, 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-bromophenoxy)-N-(2-chlorophenyl)acetamide is sourced from PubChem (CID 81499243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).