N-(5-bromo-2-methylphenyl)-2-phenoxyacetamide

C15H14BrNO2 — CID 43806384

IUPACN-(5-bromo-2-methylphenyl)-2-phenoxyacetamide
SMILESCc1ccc(Br)cc1NC(=O)COc1ccccc1
InChIInChI=1S/C15H14BrNO2/c1-11-7-8-12(16)9-14(11)17-15(18)10-19-13-5-3-2-4-6-13/h2-9H,10H2,1H3,(H,17,18)
InChIKeyVSJKMLMRZAVTOY-UHFFFAOYSA-N
MW320.19 g/mol
LogP3.78
Rot. Bonds4

About N-(5-bromo-2-methylphenyl)-2-phenoxyacetamide

N-(5-bromo-2-methylphenyl)-2-phenoxyacetamide (PubChem CID 43806384) has the molecular formula C15H14BrNO2 and a molecular weight of 320.19 g/mol. Its IUPAC name is N-(5-bromo-2-methylphenyl)-2-phenoxyacetamide.

Molecular Properties

Compound NameN-(5-bromo-2-methylphenyl)-2-phenoxyacetamide
PubChem CID43806384
Molecular FormulaC15H14BrNO2
Molecular Weight320.19 g/mol
Exact Mass319.02
IUPAC NameN-(5-bromo-2-methylphenyl)-2-phenoxyacetamide
SMILESCc1ccc(Br)cc1NC(=O)COc1ccccc1
InChIInChI=1S/C15H14BrNO2/c1-11-7-8-12(16)9-14(11)17-15(18)10-19-13-5-3-2-4-6-13/h2-9H,10H2,1H3,(H,17,18)
InChIKeyVSJKMLMRZAVTOY-UHFFFAOYSA-N
XLogP3.78
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.19
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-bromo-2-methoxyphenyl)-2-phenoxyacetamide
CID 47317656
N-(5-amino-2-methylphenyl)-2-phenoxyacetamide
CID 16794397
4-methyl-3-[(2-phenoxyacetyl)amino]benzoic acid
CID 18070473
N-(5-bromo-2-methylphenyl)-2-(2-chlorophenoxy)acetamide
CID 55804154
N-(2,5-dimethylphenyl)-2-[(2-phenoxyacetyl)amino]acetamide
CID 9314105
N-(3-acetamido-4-methylphenyl)-2-(4-bromophenoxy)acetamide
CID 54777061
N-(4-bromo-2-methylphenyl)-2-(3-methylphenoxy)acetamide;oxalic acid
CID 171154737
N-(4-bromo-2-methylphenyl)-2-(4-ethoxyphenoxy)acetamide
CID 7613552
N-[5-(1,3-dioxoisoindol-2-yl)-2-methylphenyl]-2-phenoxyacetamide
CID 110352302
N-(2-amino-4,5-dimethylphenyl)-2-phenoxyacetamide
CID 62100305
2-(3-bromophenoxy)-N-(4,5-dimethoxy-2-methylphenyl)acetamide
CID 17432048
2-(4-bromophenoxy)-N-(2,4-dimethylphenyl)acetamide
CID 874144

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-2-methylphenyl)-2-phenoxyacetamide?
The IUPAC name of N-(5-bromo-2-methylphenyl)-2-phenoxyacetamide (CID 43806384) is N-(5-bromo-2-methylphenyl)-2-phenoxyacetamide.
What is the SMILES notation for N-(5-bromo-2-methylphenyl)-2-phenoxyacetamide?
The canonical SMILES for N-(5-bromo-2-methylphenyl)-2-phenoxyacetamide is Cc1ccc(Br)cc1NC(=O)COc1ccccc1.
What is the InChIKey of N-(5-bromo-2-methylphenyl)-2-phenoxyacetamide?
The InChIKey is VSJKMLMRZAVTOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrNO2/c1-11-7-8-12(16)9-14(11)17-15(18)10-19-13-5-3-2-4-6-13/h2-9H,10H2,1H3,(H,17,18).
What are the key properties of N-(5-bromo-2-methylphenyl)-2-phenoxyacetamide?
N-(5-bromo-2-methylphenyl)-2-phenoxyacetamide has a molecular weight of 320.19 g/mol, XLogP of 3.78, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-2-methylphenyl)-2-phenoxyacetamide is sourced from PubChem (CID 43806384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).