N-(2-amino-5-chlorophenyl)-2-(2,6-dibromophenoxy)acetamide

C14H11Br2ClN2O2 — CID 29050775

IUPACN-(2-amino-5-chlorophenyl)-2-(2,6-dibromophenoxy)acetamide
SMILESNc1ccc(Cl)cc1NC(=O)COc1c(Br)cccc1Br
InChIInChI=1S/C14H11Br2ClN2O2/c15-9-2-1-3-10(16)14(9)21-7-13(20)19-12-6-8(17)4-5-11(12)18/h1-6H,7,18H2,(H,19,20)
InChIKeyGPMJTZVKRIVSIT-UHFFFAOYSA-N
MW434.52 g/mol
LogP4.46
Rot. Bonds4

About N-(2-amino-5-chlorophenyl)-2-(2,6-dibromophenoxy)acetamide

N-(2-amino-5-chlorophenyl)-2-(2,6-dibromophenoxy)acetamide (PubChem CID 29050775) has the molecular formula C14H11Br2ClN2O2 and a molecular weight of 434.52 g/mol. Its IUPAC name is N-(2-amino-5-chlorophenyl)-2-(2,6-dibromophenoxy)acetamide.

Molecular Properties

Compound NameN-(2-amino-5-chlorophenyl)-2-(2,6-dibromophenoxy)acetamide
PubChem CID29050775
Molecular FormulaC14H11Br2ClN2O2
Molecular Weight434.52 g/mol
Exact Mass431.89
IUPAC NameN-(2-amino-5-chlorophenyl)-2-(2,6-dibromophenoxy)acetamide
SMILESNc1ccc(Cl)cc1NC(=O)COc1c(Br)cccc1Br
InChIInChI=1S/C14H11Br2ClN2O2/c15-9-2-1-3-10(16)14(9)21-7-13(20)19-12-6-8(17)4-5-11(12)18/h1-6H,7,18H2,(H,19,20)
InChIKeyGPMJTZVKRIVSIT-UHFFFAOYSA-N
XLogP4.46
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.52
LogP ≤ 54.46
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-6-bromophenoxy)-N-(2-chlorophenyl)acetamide
CID 81499243
N-(2-amino-4-chlorophenyl)-2-(2,6-dimethylphenoxy)acetamide
CID 28867327
N-(2-amino-5-chlorophenyl)-2-(3-chloro-4-fluorophenoxy)acetamide
CID 63878984
N-(5-amino-2-methylphenyl)-2-(2,6-dibromophenoxy)acetamide
CID 29295025
N-(2-amino-5-fluorophenyl)-2-(2,6-dichlorophenoxy)acetamide
CID 60801946
2-[2-(aminomethyl)-6-bromophenoxy]-N-(4-chlorophenyl)acetamide
CID 61389716
N-(2-amino-5-chlorophenyl)-2-(4-cyanophenoxy)acetamide
CID 29050645
N-(2-amino-5-chlorophenyl)-2-phenylacetamide
CID 18071244
N-(2-amino-5-chlorophenyl)-2-cyclopentyloxyacetamide
CID 16793284
N-(2-amino-5-chlorophenyl)-3-bromo-2-fluorobenzamide
CID 107948709
N-(5-chloro-2-hydroxyphenyl)-2-(2,6-dimethylphenoxy)acetamide
CID 838186
2-(2-bromo-4,6-dimethylphenoxy)-N-(5-chloro-2-methylphenyl)acetamide
CID 5169100

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-5-chlorophenyl)-2-(2,6-dibromophenoxy)acetamide?
The IUPAC name of N-(2-amino-5-chlorophenyl)-2-(2,6-dibromophenoxy)acetamide (CID 29050775) is N-(2-amino-5-chlorophenyl)-2-(2,6-dibromophenoxy)acetamide.
What is the SMILES notation for N-(2-amino-5-chlorophenyl)-2-(2,6-dibromophenoxy)acetamide?
The canonical SMILES for N-(2-amino-5-chlorophenyl)-2-(2,6-dibromophenoxy)acetamide is Nc1ccc(Cl)cc1NC(=O)COc1c(Br)cccc1Br.
What is the InChIKey of N-(2-amino-5-chlorophenyl)-2-(2,6-dibromophenoxy)acetamide?
The InChIKey is GPMJTZVKRIVSIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Br2ClN2O2/c15-9-2-1-3-10(16)14(9)21-7-13(20)19-12-6-8(17)4-5-11(12)18/h1-6H,7,18H2,(H,19,20).
What are the key properties of N-(2-amino-5-chlorophenyl)-2-(2,6-dibromophenoxy)acetamide?
N-(2-amino-5-chlorophenyl)-2-(2,6-dibromophenoxy)acetamide has a molecular weight of 434.52 g/mol, XLogP of 4.46, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-5-chlorophenyl)-2-(2,6-dibromophenoxy)acetamide is sourced from PubChem (CID 29050775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).