2-amino-4-bromo-N-(5-chloro-2-ethoxyphenyl)benzamide

C15H14BrClN2O2 — CID 79703321

IUPAC2-amino-4-bromo-N-(5-chloro-2-ethoxyphenyl)benzamide
SMILESCCOc1ccc(Cl)cc1NC(=O)c1ccc(Br)cc1N
InChIInChI=1S/C15H14BrClN2O2/c1-2-21-14-6-4-10(17)8-13(14)19-15(20)11-5-3-9(16)7-12(11)18/h3-8H,2,18H2,1H3,(H,19,20)
InChIKeyMKCLLNCFNAGENG-UHFFFAOYSA-N
MW369.65 g/mol
LogP4.34
Rot. Bonds4

About 2-amino-4-bromo-N-(5-chloro-2-ethoxyphenyl)benzamide

2-amino-4-bromo-N-(5-chloro-2-ethoxyphenyl)benzamide (PubChem CID 79703321) has the molecular formula C15H14BrClN2O2 and a molecular weight of 369.65 g/mol. Its IUPAC name is 2-amino-4-bromo-N-(5-chloro-2-ethoxyphenyl)benzamide.

Molecular Properties

Compound Name2-amino-4-bromo-N-(5-chloro-2-ethoxyphenyl)benzamide
PubChem CID79703321
Molecular FormulaC15H14BrClN2O2
Molecular Weight369.65 g/mol
Exact Mass367.99
IUPAC Name2-amino-4-bromo-N-(5-chloro-2-ethoxyphenyl)benzamide
SMILESCCOc1ccc(Cl)cc1NC(=O)c1ccc(Br)cc1N
InChIInChI=1S/C15H14BrClN2O2/c1-2-21-14-6-4-10(17)8-13(14)19-15(20)11-5-3-9(16)7-12(11)18/h3-8H,2,18H2,1H3,(H,19,20)
InChIKeyMKCLLNCFNAGENG-UHFFFAOYSA-N
XLogP4.34
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.65
LogP ≤ 54.34
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

2,4-dichloro-N-(5-chloro-2-ethoxyphenyl)benzamide
CID 4779142
2-amino-4-bromo-N-(2,5-dichlorophenyl)benzamide
CID 79715050
3-amino-4-bromo-N-(5-chloro-2-ethoxyphenyl)benzamide
CID 61102222
2-bromo-N-(5-chloro-2-ethoxyphenyl)-4-fluorobenzamide
CID 55821778
5-amino-N-(5-chloro-2-ethoxyphenyl)-2-methylbenzamide
CID 61290409
2-amino-4-bromo-N-(2-bromo-4-chlorophenyl)benzamide
CID 81263873
5-bromo-2-[(5-chloro-2-ethoxybenzoyl)amino]benzoate
CID 9320369
2-amino-4-chloro-N-(2,4-dibromophenyl)benzamide
CID 61471749
2-(4-bromophenoxy)-N-(5-chloro-2-ethoxyphenyl)acetamide
CID 60536138
4-bromo-N-(5-chloro-2-methoxyphenyl)-2-fluorobenzamide
CID 26688337
2-amino-5-chloro-N-(2-ethoxy-4-methylphenyl)benzamide
CID 61104309
ethyl 6-[(5-chloro-2-ethoxyphenyl)carbamoyl]-2-methylpyridine-3-carboxylate
CID 55889019

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-bromo-N-(5-chloro-2-ethoxyphenyl)benzamide?
The IUPAC name of 2-amino-4-bromo-N-(5-chloro-2-ethoxyphenyl)benzamide (CID 79703321) is 2-amino-4-bromo-N-(5-chloro-2-ethoxyphenyl)benzamide.
What is the SMILES notation for 2-amino-4-bromo-N-(5-chloro-2-ethoxyphenyl)benzamide?
The canonical SMILES for 2-amino-4-bromo-N-(5-chloro-2-ethoxyphenyl)benzamide is CCOc1ccc(Cl)cc1NC(=O)c1ccc(Br)cc1N.
What is the InChIKey of 2-amino-4-bromo-N-(5-chloro-2-ethoxyphenyl)benzamide?
The InChIKey is MKCLLNCFNAGENG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrClN2O2/c1-2-21-14-6-4-10(17)8-13(14)19-15(20)11-5-3-9(16)7-12(11)18/h3-8H,2,18H2,1H3,(H,19,20).
What are the key properties of 2-amino-4-bromo-N-(5-chloro-2-ethoxyphenyl)benzamide?
2-amino-4-bromo-N-(5-chloro-2-ethoxyphenyl)benzamide has a molecular weight of 369.65 g/mol, XLogP of 4.34, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-bromo-N-(5-chloro-2-ethoxyphenyl)benzamide is sourced from PubChem (CID 79703321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).