2-(2-aminophenyl)-N-(5-bromo-2-chlorophenyl)acetamide

C14H12BrClN2O — CID 55132440

IUPAC2-(2-aminophenyl)-N-(5-bromo-2-chlorophenyl)acetamide
SMILESNc1ccccc1CC(=O)Nc1cc(Br)ccc1Cl
InChIInChI=1S/C14H12BrClN2O/c15-10-5-6-11(16)13(8-10)18-14(19)7-9-3-1-2-4-12(9)17/h1-6,8H,7,17H2,(H,18,19)
InChIKeyVHNMYSTZQZWATN-UHFFFAOYSA-N
MW339.62 g/mol
LogP3.87
Rot. Bonds3

About 2-(2-aminophenyl)-N-(5-bromo-2-chlorophenyl)acetamide

2-(2-aminophenyl)-N-(5-bromo-2-chlorophenyl)acetamide (PubChem CID 55132440) has the molecular formula C14H12BrClN2O and a molecular weight of 339.62 g/mol. Its IUPAC name is 2-(2-aminophenyl)-N-(5-bromo-2-chlorophenyl)acetamide.

Molecular Properties

Compound Name2-(2-aminophenyl)-N-(5-bromo-2-chlorophenyl)acetamide
PubChem CID55132440
Molecular FormulaC14H12BrClN2O
Molecular Weight339.62 g/mol
Exact Mass337.98
IUPAC Name2-(2-aminophenyl)-N-(5-bromo-2-chlorophenyl)acetamide
SMILESNc1ccccc1CC(=O)Nc1cc(Br)ccc1Cl
InChIInChI=1S/C14H12BrClN2O/c15-10-5-6-11(16)13(8-10)18-14(19)7-9-3-1-2-4-12(9)17/h1-6,8H,7,17H2,(H,18,19)
InChIKeyVHNMYSTZQZWATN-UHFFFAOYSA-N
XLogP3.87
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.62
LogP ≤ 53.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(5-bromo-2-chlorophenyl)-2-(2-nitrophenyl)acetamide
CID 62909951
2-(2-aminophenyl)-N-(4-bromo-2,3-dichlorophenyl)acetamide
CID 107786724
N-(5-amino-2-chlorophenyl)-2-(2-chlorophenyl)acetamide
CID 43548799
N-(4-bromo-2-chlorophenyl)-2-(2-hydroxyphenyl)acetamide
CID 80741026
N-(5-bromo-2-chlorophenyl)-2-thiophen-2-ylacetamide
CID 62908415
N-(5-bromo-2-chlorophenyl)-3-phenylpropanamide
CID 62908416
2-(2-aminophenyl)-N-(4-chloro-3-fluorophenyl)acetamide
CID 61466448
2-(2-aminophenyl)-N-(2-bromo-5-fluorophenyl)acetamide
CID 103832912
N-(5-bromo-2-chlorophenyl)-3-(furan-2-yl)propanamide
CID 62909114
N-(5-bromo-2-chlorophenyl)-2-(3-methoxyphenyl)acetamide
CID 62909620
N-(5-bromo-2-chlorophenyl)-3-(methylamino)propanamide
CID 62908403
N-(5-bromo-2-chlorophenyl)-5-hydroxypentanamide
CID 79198656

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminophenyl)-N-(5-bromo-2-chlorophenyl)acetamide?
The IUPAC name of 2-(2-aminophenyl)-N-(5-bromo-2-chlorophenyl)acetamide (CID 55132440) is 2-(2-aminophenyl)-N-(5-bromo-2-chlorophenyl)acetamide.
What is the SMILES notation for 2-(2-aminophenyl)-N-(5-bromo-2-chlorophenyl)acetamide?
The canonical SMILES for 2-(2-aminophenyl)-N-(5-bromo-2-chlorophenyl)acetamide is Nc1ccccc1CC(=O)Nc1cc(Br)ccc1Cl.
What is the InChIKey of 2-(2-aminophenyl)-N-(5-bromo-2-chlorophenyl)acetamide?
The InChIKey is VHNMYSTZQZWATN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12BrClN2O/c15-10-5-6-11(16)13(8-10)18-14(19)7-9-3-1-2-4-12(9)17/h1-6,8H,7,17H2,(H,18,19).
What are the key properties of 2-(2-aminophenyl)-N-(5-bromo-2-chlorophenyl)acetamide?
2-(2-aminophenyl)-N-(5-bromo-2-chlorophenyl)acetamide has a molecular weight of 339.62 g/mol, XLogP of 3.87, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminophenyl)-N-(5-bromo-2-chlorophenyl)acetamide is sourced from PubChem (CID 55132440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).