2-(4-bromo-2-chloro-6-methylphenoxy)-N-(3-methoxyphenyl)acetamide

C16H15BrClNO3 — CID 7290642

IUPAC2-(4-bromo-2-chloro-6-methylphenoxy)-N-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(NC(=O)COc2c(C)cc(Br)cc2Cl)c1
InChIInChI=1S/C16H15BrClNO3/c1-10-6-11(17)7-14(18)16(10)22-9-15(20)19-12-4-3-5-13(8-12)21-2/h3-8H,9H2,1-2H3,(H,19,20)
InChIKeyWUUIHUXJMZJQSJ-UHFFFAOYSA-N
MW384.66 g/mol
LogP4.44
Rot. Bonds5

About 2-(4-bromo-2-chloro-6-methylphenoxy)-N-(3-methoxyphenyl)acetamide

2-(4-bromo-2-chloro-6-methylphenoxy)-N-(3-methoxyphenyl)acetamide (PubChem CID 7290642) has the molecular formula C16H15BrClNO3 and a molecular weight of 384.66 g/mol. Its IUPAC name is 2-(4-bromo-2-chloro-6-methylphenoxy)-N-(3-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(4-bromo-2-chloro-6-methylphenoxy)-N-(3-methoxyphenyl)acetamide
PubChem CID7290642
Molecular FormulaC16H15BrClNO3
Molecular Weight384.66 g/mol
Exact Mass382.99
IUPAC Name2-(4-bromo-2-chloro-6-methylphenoxy)-N-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(NC(=O)COc2c(C)cc(Br)cc2Cl)c1
InChIInChI=1S/C16H15BrClNO3/c1-10-6-11(17)7-14(18)16(10)22-9-15(20)19-12-4-3-5-13(8-12)21-2/h3-8H,9H2,1-2H3,(H,19,20)
InChIKeyWUUIHUXJMZJQSJ-UHFFFAOYSA-N
XLogP4.44
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.66
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(3-methoxyanilino)-2-oxoethyl] 2-(4-bromo-2-chloro-6-methylphenoxy)acetate
CID 41059684
N-(3-acetylphenyl)-2-(4-bromo-2-chloro-6-methylphenoxy)acetamide
CID 2610777
2-(4-bromo-2-chloro-6-methylphenoxy)-N-(3,5-dimethylphenyl)acetamide
CID 7233561
N-(3-methoxyphenyl)-2-(2,3,6-trimethylphenoxy)acetamide
CID 731174
2-(2-bromophenoxy)-N-(3-methoxyphenyl)acetamide
CID 729437
2-(2,4-dibromo-6-methylphenoxy)-N-[3-(2-phenoxyethoxy)phenyl]acetamide
CID 17123513
2-(3-methoxyphenoxy)-N-(3-methoxyphenyl)acetamide
CID 19204025
N-(3-butoxyphenyl)-2-(2,4-dibromo-6-methylphenoxy)acetamide
CID 17095038
2-(2-bromo-4-methylphenoxy)-N-(3-methoxyphenyl)acetamide
CID 1008619
2-(4-bromo-2-chloro-6-methylphenoxy)-N-[4-(cyanomethyl)phenyl]acetamide
CID 7629417
2-(4-bromo-2-chloro-6-methylphenoxy)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 7233584
2-(4-bromo-2,6-dimethylphenoxy)-N-(3,4-dimethoxyphenyl)acetamide
CID 19175722

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromo-2-chloro-6-methylphenoxy)-N-(3-methoxyphenyl)acetamide?
The IUPAC name of 2-(4-bromo-2-chloro-6-methylphenoxy)-N-(3-methoxyphenyl)acetamide (CID 7290642) is 2-(4-bromo-2-chloro-6-methylphenoxy)-N-(3-methoxyphenyl)acetamide.
What is the SMILES notation for 2-(4-bromo-2-chloro-6-methylphenoxy)-N-(3-methoxyphenyl)acetamide?
The canonical SMILES for 2-(4-bromo-2-chloro-6-methylphenoxy)-N-(3-methoxyphenyl)acetamide is COc1cccc(NC(=O)COc2c(C)cc(Br)cc2Cl)c1.
What is the InChIKey of 2-(4-bromo-2-chloro-6-methylphenoxy)-N-(3-methoxyphenyl)acetamide?
The InChIKey is WUUIHUXJMZJQSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15BrClNO3/c1-10-6-11(17)7-14(18)16(10)22-9-15(20)19-12-4-3-5-13(8-12)21-2/h3-8H,9H2,1-2H3,(H,19,20).
What are the key properties of 2-(4-bromo-2-chloro-6-methylphenoxy)-N-(3-methoxyphenyl)acetamide?
2-(4-bromo-2-chloro-6-methylphenoxy)-N-(3-methoxyphenyl)acetamide has a molecular weight of 384.66 g/mol, XLogP of 4.44, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromo-2-chloro-6-methylphenoxy)-N-(3-methoxyphenyl)acetamide is sourced from PubChem (CID 7290642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).