2-(4-chloro-2-methylphenoxy)-N-(2,6-dimethylphenyl)acetamide

C17H18ClNO2 — CID 803437

IUPAC2-(4-chloro-2-methylphenoxy)-N-(2,6-dimethylphenyl)acetamide
SMILESCc1cc(Cl)ccc1OCC(=O)Nc1c(C)cccc1C
InChIInChI=1S/C17H18ClNO2/c1-11-5-4-6-12(2)17(11)19-16(20)10-21-15-8-7-14(18)9-13(15)3/h4-9H,10H2,1-3H3,(H,19,20)
InChIKeyYAAOGWRNCVNBRT-UHFFFAOYSA-N
MW303.79 g/mol
LogP4.28
Rot. Bonds4

About 2-(4-chloro-2-methylphenoxy)-N-(2,6-dimethylphenyl)acetamide

2-(4-chloro-2-methylphenoxy)-N-(2,6-dimethylphenyl)acetamide (PubChem CID 803437) has the molecular formula C17H18ClNO2 and a molecular weight of 303.79 g/mol. Its IUPAC name is 2-(4-chloro-2-methylphenoxy)-N-(2,6-dimethylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-chloro-2-methylphenoxy)-N-(2,6-dimethylphenyl)acetamide
PubChem CID803437
Molecular FormulaC17H18ClNO2
Molecular Weight303.79 g/mol
Exact Mass303.10
IUPAC Name2-(4-chloro-2-methylphenoxy)-N-(2,6-dimethylphenyl)acetamide
SMILESCc1cc(Cl)ccc1OCC(=O)Nc1c(C)cccc1C
InChIInChI=1S/C17H18ClNO2/c1-11-5-4-6-12(2)17(11)19-16(20)10-21-15-8-7-14(18)9-13(15)3/h4-9H,10H2,1-3H3,(H,19,20)
InChIKeyYAAOGWRNCVNBRT-UHFFFAOYSA-N
XLogP4.28
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.79
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-(2-ethyl-6-methylanilino)-2-oxoethyl] 2-(4-chloro-2-methylphenoxy)acetate
CID 7994602
2-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]-N-(2,4,6-trimethylphenyl)acetamide
CID 16548228
N-[3-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]-2-methylphenyl]propanamide
CID 38300862
2-(4-chloro-2-methylphenoxy)-N-(2,4-dichlorophenyl)acetamide
CID 923084
2-(4-bromo-2-chlorophenoxy)-N-(2,6-dimethylphenyl)acetamide
CID 2230439
[2-(2-methyl-6-nitroanilino)-2-oxoethyl] 2-(4-chloro-2-methylphenoxy)acetate
CID 8021074
N-(2-amino-4-chlorophenyl)-2-(4-chloro-2-methylphenoxy)acetamide
CID 29045302
N-(4-aminophenyl)-2-(4-chloro-2-methylphenoxy)acetamide
CID 16789348
2-(4-bromo-2-methylphenoxy)-N-(3-chlorophenyl)acetamide
CID 3483118
[2-(2,3-dimethylanilino)-2-oxoethyl] 2-(4-chloro-2-methylphenoxy)acetate
CID 7779559
2-(4-chloro-2-methylphenoxy)-N-(2-chloro-4-methylphenyl)acetamide
CID 7926730
N'-[2-(4-chloro-2-methylphenoxy)acetyl]-2-(4-chlorophenoxy)acetohydrazide
CID 5186778

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-2-methylphenoxy)-N-(2,6-dimethylphenyl)acetamide?
The IUPAC name of 2-(4-chloro-2-methylphenoxy)-N-(2,6-dimethylphenyl)acetamide (CID 803437) is 2-(4-chloro-2-methylphenoxy)-N-(2,6-dimethylphenyl)acetamide.
What is the SMILES notation for 2-(4-chloro-2-methylphenoxy)-N-(2,6-dimethylphenyl)acetamide?
The canonical SMILES for 2-(4-chloro-2-methylphenoxy)-N-(2,6-dimethylphenyl)acetamide is Cc1cc(Cl)ccc1OCC(=O)Nc1c(C)cccc1C.
What is the InChIKey of 2-(4-chloro-2-methylphenoxy)-N-(2,6-dimethylphenyl)acetamide?
The InChIKey is YAAOGWRNCVNBRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18ClNO2/c1-11-5-4-6-12(2)17(11)19-16(20)10-21-15-8-7-14(18)9-13(15)3/h4-9H,10H2,1-3H3,(H,19,20).
What are the key properties of 2-(4-chloro-2-methylphenoxy)-N-(2,6-dimethylphenyl)acetamide?
2-(4-chloro-2-methylphenoxy)-N-(2,6-dimethylphenyl)acetamide has a molecular weight of 303.79 g/mol, XLogP of 4.28, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloro-2-methylphenoxy)-N-(2,6-dimethylphenyl)acetamide is sourced from PubChem (CID 803437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).