2-(4-bromo-2-chlorophenoxy)-N-(2,6-dimethylphenyl)acetamide

C16H15BrClNO2 — CID 2230439

IUPAC2-(4-bromo-2-chlorophenoxy)-N-(2,6-dimethylphenyl)acetamide
SMILESCc1cccc(C)c1NC(=O)COc1ccc(Br)cc1Cl
InChIInChI=1S/C16H15BrClNO2/c1-10-4-3-5-11(2)16(10)19-15(20)9-21-14-7-6-12(17)8-13(14)18/h3-8H,9H2,1-2H3,(H,19,20)
InChIKeyJUCBTQDEAYMROI-UHFFFAOYSA-N
MW368.66 g/mol
LogP4.74
Rot. Bonds4

About 2-(4-bromo-2-chlorophenoxy)-N-(2,6-dimethylphenyl)acetamide

2-(4-bromo-2-chlorophenoxy)-N-(2,6-dimethylphenyl)acetamide (PubChem CID 2230439) has the molecular formula C16H15BrClNO2 and a molecular weight of 368.66 g/mol. Its IUPAC name is 2-(4-bromo-2-chlorophenoxy)-N-(2,6-dimethylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-bromo-2-chlorophenoxy)-N-(2,6-dimethylphenyl)acetamide
PubChem CID2230439
Molecular FormulaC16H15BrClNO2
Molecular Weight368.66 g/mol
Exact Mass367.00
IUPAC Name2-(4-bromo-2-chlorophenoxy)-N-(2,6-dimethylphenyl)acetamide
SMILESCc1cccc(C)c1NC(=O)COc1ccc(Br)cc1Cl
InChIInChI=1S/C16H15BrClNO2/c1-10-4-3-5-11(2)16(10)19-15(20)9-21-14-7-6-12(17)8-13(14)18/h3-8H,9H2,1-2H3,(H,19,20)
InChIKeyJUCBTQDEAYMROI-UHFFFAOYSA-N
XLogP4.74
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.66
LogP ≤ 54.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-bromo-2-chlorophenoxy)-N-(3-methyl-2-pyridinyl)acetamide
CID 17173876
2-(4-chloro-2-methylphenoxy)-N-(2,6-dimethylphenyl)acetamide
CID 803437
2-(5-bromo-2-chlorophenoxy)-N-(2,4,6-trimethylphenyl)acetamide
CID 112828409
3-[[2-(4-bromo-2-chlorophenoxy)acetyl]amino]-4-methylbenzoic acid
CID 45429183
2-(4-bromo-2-chlorophenoxy)-N-(3-propan-2-yloxyphenyl)acetamide
CID 17154711
methyl 3-chloro-4-[2-(2-ethyl-6-methylanilino)-2-oxoethoxy]benzoate
CID 55320823
(2,3-dimethylphenyl) 2-(4-bromo-2-chlorophenoxy)acetate
CID 2235068
N-(5-bromo-2-methylphenyl)-2-(2-chlorophenoxy)acetamide
CID 55804154
2-(4-bromo-2-chlorophenoxy)-N-tert-butylacetamide
CID 885602
2-(4-bromo-2-ethylphenoxy)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 19201614
2-(4-bromo-2-chlorophenoxy)-N'-[2-(2-methoxyphenoxy)acetyl]acetohydrazide
CID 4633037
2-(4-bromo-2-methylphenoxy)-N-(3-chlorophenyl)acetamide
CID 3483118

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromo-2-chlorophenoxy)-N-(2,6-dimethylphenyl)acetamide?
The IUPAC name of 2-(4-bromo-2-chlorophenoxy)-N-(2,6-dimethylphenyl)acetamide (CID 2230439) is 2-(4-bromo-2-chlorophenoxy)-N-(2,6-dimethylphenyl)acetamide.
What is the SMILES notation for 2-(4-bromo-2-chlorophenoxy)-N-(2,6-dimethylphenyl)acetamide?
The canonical SMILES for 2-(4-bromo-2-chlorophenoxy)-N-(2,6-dimethylphenyl)acetamide is Cc1cccc(C)c1NC(=O)COc1ccc(Br)cc1Cl.
What is the InChIKey of 2-(4-bromo-2-chlorophenoxy)-N-(2,6-dimethylphenyl)acetamide?
The InChIKey is JUCBTQDEAYMROI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15BrClNO2/c1-10-4-3-5-11(2)16(10)19-15(20)9-21-14-7-6-12(17)8-13(14)18/h3-8H,9H2,1-2H3,(H,19,20).
What are the key properties of 2-(4-bromo-2-chlorophenoxy)-N-(2,6-dimethylphenyl)acetamide?
2-(4-bromo-2-chlorophenoxy)-N-(2,6-dimethylphenyl)acetamide has a molecular weight of 368.66 g/mol, XLogP of 4.74, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromo-2-chlorophenoxy)-N-(2,6-dimethylphenyl)acetamide is sourced from PubChem (CID 2230439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).