2-(4-bromo-2-methylphenoxy)acetamide

C9H10BrNO2 — CID 803456

IUPAC2-(4-bromo-2-methylphenoxy)acetamide
SMILESCc1cc(Br)ccc1OCC(N)=O
InChIInChI=1S/C9H10BrNO2/c1-6-4-7(10)2-3-8(6)13-5-9(11)12/h2-4H,5H2,1H3,(H2,11,12)
InChIKeyJMDNALLRVXHSPT-UHFFFAOYSA-N
MW244.09 g/mol
LogP1.62
Rot. Bonds3

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

2-(4-bromo-2-methylphenoxy)acetamide (PubChem CID 803456) has the molecular formula C9H10BrNO2 and a molecular weight of 244.09 g/mol. Its IUPAC name is 2-(4-bromo-2-methylphenoxy)acetamide.

Molecular Properties

Compound Name2-(4-bromo-2-methylphenoxy)acetamide
PubChem CID803456
Molecular FormulaC9H10BrNO2
Molecular Weight244.09 g/mol
Exact Mass242.99
IUPAC Name2-(4-bromo-2-methylphenoxy)acetamide
SMILESCc1cc(Br)ccc1OCC(N)=O
InChIInChI=1S/C9H10BrNO2/c1-6-4-7(10)2-3-8(6)13-5-9(11)12/h2-4H,5H2,1H3,(H2,11,12)
InChIKeyJMDNALLRVXHSPT-UHFFFAOYSA-N
XLogP1.62
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.09
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4-bromo-2,6-dimethylphenyl) 2-(4-bromo-2-methylphenoxy)acetate
CID 3307497
2-(4-bromo-2-methylphenoxy)-N-[3-[[2-(4-bromo-2-methylphenoxy)acetyl]amino]propyl]acetamide
CID 4981184
2-(4-bromo-2-methylphenoxy)-1-(3-bromophenyl)ethanone
CID 55221609
2-(4-bromo-2-methylphenoxy)-N-(3,5-dimethylphenyl)acetamide
CID 695854
2-[2-(1-aminoethyl)-5-bromophenoxy]acetamide
CID 102946264
2-[(4-bromo-2-methylphenoxy)methyl]prop-2-ene-1-thiol
CID 103073803
2-(4-bromo-2-methylphenoxy)-1-(4-ethoxyphenyl)ethanone
CID 63566036
2-(4-bromo-2-methylphenoxy)-1-(furan-2-yl)ethanone
CID 55026653
2-[2-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]acetamide
CID 155887529
N-(2-acetamidophenyl)-2-(4-bromo-2-methylphenoxy)acetamide
CID 1328492
2-[4-bromo-2-(propylaminomethyl)phenoxy]acetamide;hydrochloride
CID 17053780
cyclohexyl 2-(4-bromo-2-methylphenoxy)acetate
CID 4925253

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromo-2-methylphenoxy)acetamide?
The IUPAC name of 2-(4-bromo-2-methylphenoxy)acetamide (CID 803456) is 2-(4-bromo-2-methylphenoxy)acetamide.
What is the SMILES notation for 2-(4-bromo-2-methylphenoxy)acetamide?
The canonical SMILES for 2-(4-bromo-2-methylphenoxy)acetamide is Cc1cc(Br)ccc1OCC(N)=O.
What is the InChIKey of 2-(4-bromo-2-methylphenoxy)acetamide?
The InChIKey is JMDNALLRVXHSPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10BrNO2/c1-6-4-7(10)2-3-8(6)13-5-9(11)12/h2-4H,5H2,1H3,(H2,11,12).
What are the key properties of 2-(4-bromo-2-methylphenoxy)acetamide?
2-(4-bromo-2-methylphenoxy)acetamide has a molecular weight of 244.09 g/mol, XLogP of 1.62, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromo-2-methylphenoxy)acetamide is sourced from PubChem (CID 803456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).