2-(4-bromophenoxy)-N-(2,4-dimethylphenyl)acetamide

C16H16BrNO2 — CID 874144

IUPAC2-(4-bromophenoxy)-N-(2,4-dimethylphenyl)acetamide
SMILESCc1ccc(NC(=O)COc2ccc(Br)cc2)c(C)c1
InChIInChI=1S/C16H16BrNO2/c1-11-3-8-15(12(2)9-11)18-16(19)10-20-14-6-4-13(17)5-7-14/h3-9H,10H2,1-2H3,(H,18,19)
InChIKeyVYRMFLIPPMASBB-UHFFFAOYSA-N
MW334.21 g/mol
LogP4.08
Rot. Bonds4

About 2-(4-bromophenoxy)-N-(2,4-dimethylphenyl)acetamide

2-(4-bromophenoxy)-N-(2,4-dimethylphenyl)acetamide (PubChem CID 874144) has the molecular formula C16H16BrNO2 and a molecular weight of 334.21 g/mol. Its IUPAC name is 2-(4-bromophenoxy)-N-(2,4-dimethylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-bromophenoxy)-N-(2,4-dimethylphenyl)acetamide
PubChem CID874144
Molecular FormulaC16H16BrNO2
Molecular Weight334.21 g/mol
Exact Mass333.04
IUPAC Name2-(4-bromophenoxy)-N-(2,4-dimethylphenyl)acetamide
SMILESCc1ccc(NC(=O)COc2ccc(Br)cc2)c(C)c1
InChIInChI=1S/C16H16BrNO2/c1-11-3-8-15(12(2)9-11)18-16(19)10-20-14-6-4-13(17)5-7-14/h3-9H,10H2,1-2H3,(H,18,19)
InChIKeyVYRMFLIPPMASBB-UHFFFAOYSA-N
XLogP4.08
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.21
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,4-dimethylphenyl)-2-(4-methoxyphenoxy)acetamide
CID 625191
N-(2-amino-4-methylphenyl)-2-(4-bromophenoxy)acetamide
CID 43376437
N-(4-bromo-2-methylphenyl)-2-(4-ethoxyphenoxy)acetamide
CID 7613552
4-[2-(2,4-dimethylanilino)-2-oxoethoxy]benzoic acid
CID 4026014
2-(4-bromophenoxy)-N-(4-methyl-2-propoxyphenyl)acetamide
CID 55901846
methyl 2-[4-[2-(2,4-dimethylanilino)-2-oxoethoxy]phenyl]acetate
CID 7695217
N-(2,4-dimethylphenyl)-2-[4-(2-methylbutan-2-yl)phenoxy]acetamide
CID 17093188
N-(4-bromo-2-methylphenyl)-2-(3-methylphenoxy)acetamide;oxalic acid
CID 171154737
ethyl 4-[2-(4-bromo-2-methylanilino)-2-oxoethoxy]benzoate
CID 34568390
2-(4-bromophenyl)-N-(2,4-dimethylphenyl)acetamide
CID 2600129
N-(4-chloro-2-methylphenyl)-2-[4-(4-methylphenyl)phenoxy]acetamide
CID 19174143
N-(4-bromo-2-iodophenyl)-2-(4-bromophenoxy)acetamide
CID 3967654

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenoxy)-N-(2,4-dimethylphenyl)acetamide?
The IUPAC name of 2-(4-bromophenoxy)-N-(2,4-dimethylphenyl)acetamide (CID 874144) is 2-(4-bromophenoxy)-N-(2,4-dimethylphenyl)acetamide.
What is the SMILES notation for 2-(4-bromophenoxy)-N-(2,4-dimethylphenyl)acetamide?
The canonical SMILES for 2-(4-bromophenoxy)-N-(2,4-dimethylphenyl)acetamide is Cc1ccc(NC(=O)COc2ccc(Br)cc2)c(C)c1.
What is the InChIKey of 2-(4-bromophenoxy)-N-(2,4-dimethylphenyl)acetamide?
The InChIKey is VYRMFLIPPMASBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16BrNO2/c1-11-3-8-15(12(2)9-11)18-16(19)10-20-14-6-4-13(17)5-7-14/h3-9H,10H2,1-2H3,(H,18,19).
What are the key properties of 2-(4-bromophenoxy)-N-(2,4-dimethylphenyl)acetamide?
2-(4-bromophenoxy)-N-(2,4-dimethylphenyl)acetamide has a molecular weight of 334.21 g/mol, XLogP of 4.08, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenoxy)-N-(2,4-dimethylphenyl)acetamide is sourced from PubChem (CID 874144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).