2-(2-bromo-4-methylphenyl)acetamide

C9H10BrNO — CID 158519264

IUPAC2-(2-bromo-4-methylphenyl)acetamide
SMILESCc1ccc(CC(N)=O)c(Br)c1
InChIInChI=1S/C9H10BrNO/c1-6-2-3-7(5-9(11)12)8(10)4-6/h2-4H,5H2,1H3,(H2,11,12)
InChIKeyNWGHLYMWWRJUTQ-UHFFFAOYSA-N
MW228.09 g/mol
LogP1.79
Rot. Bonds2

About 2-(2-bromo-4-methylphenyl)acetamide

2-(2-bromo-4-methylphenyl)acetamide (PubChem CID 158519264) has the molecular formula C9H10BrNO and a molecular weight of 228.09 g/mol. Its IUPAC name is 2-(2-bromo-4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-bromo-4-methylphenyl)acetamide
PubChem CID158519264
Molecular FormulaC9H10BrNO
Molecular Weight228.09 g/mol
Exact Mass226.99
IUPAC Name2-(2-bromo-4-methylphenyl)acetamide
SMILESCc1ccc(CC(N)=O)c(Br)c1
InChIInChI=1S/C9H10BrNO/c1-6-2-3-7(5-9(11)12)8(10)4-6/h2-4H,5H2,1H3,(H2,11,12)
InChIKeyNWGHLYMWWRJUTQ-UHFFFAOYSA-N
XLogP1.79
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.09
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-bromo-5-methylphenyl)acetamide
CID 71440517
(2S)-1-(2-bromo-4-methylphenyl)propan-2-amine
CID 131058214
4-(2-bromo-4-methylphenyl)butanethioamide
CID 83924462
2-(2-ethoxy-4-methylphenyl)acetamide
CID 146656384
3-(2-bromo-4-methylphenyl)-2-methylpropanoic acid
CID 83731619
5-(2-bromo-4-methylphenyl)-4-methylpentan-2-one
CID 83924454
3-[(2-bromo-4-methylphenyl)methylamino]-5-fluoro-4-methylbenzamide
CID 115556847
2-(hydroxymethyl)-5-methylbenzamide
CID 166888103
2-[4-[[2-(2-bromo-4-methylphenoxy)acetyl]amino]phenyl]acetamide
CID 31857859
2-(2,6-dimethylquinolin-4-yl)acetamide
CID 82575379
1-(2-bromo-4-methylphenyl)butan-2-amine;hydrochloride
CID 170889223
2-(3-bromo-4-hydroxyphenyl)acetamide
CID 57224771

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromo-4-methylphenyl)acetamide?
The IUPAC name of 2-(2-bromo-4-methylphenyl)acetamide (CID 158519264) is 2-(2-bromo-4-methylphenyl)acetamide.
What is the SMILES notation for 2-(2-bromo-4-methylphenyl)acetamide?
The canonical SMILES for 2-(2-bromo-4-methylphenyl)acetamide is Cc1ccc(CC(N)=O)c(Br)c1.
What is the InChIKey of 2-(2-bromo-4-methylphenyl)acetamide?
The InChIKey is NWGHLYMWWRJUTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10BrNO/c1-6-2-3-7(5-9(11)12)8(10)4-6/h2-4H,5H2,1H3,(H2,11,12).
What are the key properties of 2-(2-bromo-4-methylphenyl)acetamide?
2-(2-bromo-4-methylphenyl)acetamide has a molecular weight of 228.09 g/mol, XLogP of 1.79, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromo-4-methylphenyl)acetamide is sourced from PubChem (CID 158519264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).