N-(2-methoxy-5-methylphenyl)-2-(2,4,6-trichlorophenoxy)acetamide

C16H14Cl3NO3 — CID 7275215

IUPACN-(2-methoxy-5-methylphenyl)-2-(2,4,6-trichlorophenoxy)acetamide
SMILESCOc1ccc(C)cc1NC(=O)COc1c(Cl)cc(Cl)cc1Cl
InChIInChI=1S/C16H14Cl3NO3/c1-9-3-4-14(22-2)13(5-9)20-15(21)8-23-16-11(18)6-10(17)7-12(16)19/h3-7H,8H2,1-2H3,(H,20,21)
InChIKeyQGCCJFMUBKUEMA-UHFFFAOYSA-N
MW374.65 g/mol
LogP4.98
Rot. Bonds5

About N-(2-methoxy-5-methylphenyl)-2-(2,4,6-trichlorophenoxy)acetamide

N-(2-methoxy-5-methylphenyl)-2-(2,4,6-trichlorophenoxy)acetamide (PubChem CID 7275215) has the molecular formula C16H14Cl3NO3 and a molecular weight of 374.65 g/mol. Its IUPAC name is N-(2-methoxy-5-methylphenyl)-2-(2,4,6-trichlorophenoxy)acetamide.

Molecular Properties

Compound NameN-(2-methoxy-5-methylphenyl)-2-(2,4,6-trichlorophenoxy)acetamide
PubChem CID7275215
Molecular FormulaC16H14Cl3NO3
Molecular Weight374.65 g/mol
Exact Mass373.00
IUPAC NameN-(2-methoxy-5-methylphenyl)-2-(2,4,6-trichlorophenoxy)acetamide
SMILESCOc1ccc(C)cc1NC(=O)COc1c(Cl)cc(Cl)cc1Cl
InChIInChI=1S/C16H14Cl3NO3/c1-9-3-4-14(22-2)13(5-9)20-15(21)8-23-16-11(18)6-10(17)7-12(16)19/h3-7H,8H2,1-2H3,(H,20,21)
InChIKeyQGCCJFMUBKUEMA-UHFFFAOYSA-N
XLogP4.98
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.65
LogP ≤ 54.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-chloro-6-ethoxy-4-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide
CID 28913481
N-(2,4-dimethoxyphenyl)-2-(2,4,6-trichlorophenoxy)acetamide
CID 7275265
2-(3,5-dimethoxyphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide
CID 7707192
2-(2,5-dimethylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide
CID 807483
N-(2,5-dichlorophenyl)-2-(2-methoxy-4-methylphenoxy)acetamide
CID 35987064
2-(2-chloro-5-methylphenoxy)-N-(2,5-dimethoxyphenyl)acetamide
CID 7778322
2-(2,4-dichloroanilino)-N-(2-methoxy-5-methylphenyl)acetamide
CID 26417516
N-(5-chloro-2-methoxyphenyl)-2-(2,4,6-trichloro-3,5-dimethylphenoxy)acetamide
CID 22777920
N-(4-chloro-2-methylphenyl)-2-(2-methoxy-4-methylphenoxy)acetamide
CID 2627654
2-(2,4-dichloro-6-methylphenoxy)-N-(3,4-dimethoxyphenyl)acetamide
CID 1348476
2-(4-bromo-2,6-dimethylphenoxy)-N-(5-chloro-2-methoxyphenyl)acetamide
CID 19180419
2-(4-bromo-2-methylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide
CID 1363313

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-5-methylphenyl)-2-(2,4,6-trichlorophenoxy)acetamide?
The IUPAC name of N-(2-methoxy-5-methylphenyl)-2-(2,4,6-trichlorophenoxy)acetamide (CID 7275215) is N-(2-methoxy-5-methylphenyl)-2-(2,4,6-trichlorophenoxy)acetamide.
What is the SMILES notation for N-(2-methoxy-5-methylphenyl)-2-(2,4,6-trichlorophenoxy)acetamide?
The canonical SMILES for N-(2-methoxy-5-methylphenyl)-2-(2,4,6-trichlorophenoxy)acetamide is COc1ccc(C)cc1NC(=O)COc1c(Cl)cc(Cl)cc1Cl.
What is the InChIKey of N-(2-methoxy-5-methylphenyl)-2-(2,4,6-trichlorophenoxy)acetamide?
The InChIKey is QGCCJFMUBKUEMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14Cl3NO3/c1-9-3-4-14(22-2)13(5-9)20-15(21)8-23-16-11(18)6-10(17)7-12(16)19/h3-7H,8H2,1-2H3,(H,20,21).
What are the key properties of N-(2-methoxy-5-methylphenyl)-2-(2,4,6-trichlorophenoxy)acetamide?
N-(2-methoxy-5-methylphenyl)-2-(2,4,6-trichlorophenoxy)acetamide has a molecular weight of 374.65 g/mol, XLogP of 4.98, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-5-methylphenyl)-2-(2,4,6-trichlorophenoxy)acetamide is sourced from PubChem (CID 7275215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).