2-(2-chloro-5-methylphenoxy)-N-(2-propan-2-ylphenyl)acetamide

C18H20ClNO2 — CID 7642804

IUPAC2-(2-chloro-5-methylphenoxy)-N-(2-propan-2-ylphenyl)acetamide
SMILESCc1ccc(Cl)c(OCC(=O)Nc2ccccc2C(C)C)c1
InChIInChI=1S/C18H20ClNO2/c1-12(2)14-6-4-5-7-16(14)20-18(21)11-22-17-10-13(3)8-9-15(17)19/h4-10,12H,11H2,1-3H3,(H,20,21)
InChIKeyGARSRRWWHBZFFK-UHFFFAOYSA-N
MW317.82 g/mol
LogP4.79
Rot. Bonds5

About 2-(2-chloro-5-methylphenoxy)-N-(2-propan-2-ylphenyl)acetamide

2-(2-chloro-5-methylphenoxy)-N-(2-propan-2-ylphenyl)acetamide (PubChem CID 7642804) has the molecular formula C18H20ClNO2 and a molecular weight of 317.82 g/mol. Its IUPAC name is 2-(2-chloro-5-methylphenoxy)-N-(2-propan-2-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-chloro-5-methylphenoxy)-N-(2-propan-2-ylphenyl)acetamide
PubChem CID7642804
Molecular FormulaC18H20ClNO2
Molecular Weight317.82 g/mol
Exact Mass317.12
IUPAC Name2-(2-chloro-5-methylphenoxy)-N-(2-propan-2-ylphenyl)acetamide
SMILESCc1ccc(Cl)c(OCC(=O)Nc2ccccc2C(C)C)c1
InChIInChI=1S/C18H20ClNO2/c1-12(2)14-6-4-5-7-16(14)20-18(21)11-22-17-10-13(3)8-9-15(17)19/h4-10,12H,11H2,1-3H3,(H,20,21)
InChIKeyGARSRRWWHBZFFK-UHFFFAOYSA-N
XLogP4.79
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.82
LogP ≤ 54.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-chloro-5-methylphenoxy)-N-(2-chlorophenyl)acetamide
CID 2611371
2-(2-chloro-5-methylphenoxy)-N-(2-fluorophenyl)acetamide
CID 7642832
N-[2-[(2R)-butan-2-yl]phenyl]-2-(5-methyl-2-propan-2-ylphenoxy)acetamide
CID 959796
2-(2-hydroxyphenoxy)-N-(2-propan-2-ylphenyl)acetamide
CID 78781647
N-(2-acetylphenyl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide
CID 7948552
2-[[2-(5-methyl-2-propan-2-ylphenoxy)acetyl]amino]benzoic acid
CID 4863455
2-(5-methyl-2-propan-2-ylphenoxy)-N-[2-(trifluoromethoxy)phenyl]acetamide
CID 18272936
[2-oxo-2-(2-propan-2-ylanilino)ethyl] 2-(2,4-dichlorophenoxy)acetate
CID 2378781
2-(2,3,4,5,6-pentachlorophenoxy)-N-(2-propan-2-ylphenyl)acetamide
CID 19178086
[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl] 2-(2-chloro-5-methylphenoxy)acetate
CID 7570538
2-(5-methyl-2-propan-2-ylphenoxy)-N-(2-phenylphenyl)acetamide
CID 7929961
N-(5-chloro-2,4-dimethoxyphenyl)-2-(5-methyl-2-propan-2-ylphenoxy)acetamide
CID 1020008

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-5-methylphenoxy)-N-(2-propan-2-ylphenyl)acetamide?
The IUPAC name of 2-(2-chloro-5-methylphenoxy)-N-(2-propan-2-ylphenyl)acetamide (CID 7642804) is 2-(2-chloro-5-methylphenoxy)-N-(2-propan-2-ylphenyl)acetamide.
What is the SMILES notation for 2-(2-chloro-5-methylphenoxy)-N-(2-propan-2-ylphenyl)acetamide?
The canonical SMILES for 2-(2-chloro-5-methylphenoxy)-N-(2-propan-2-ylphenyl)acetamide is Cc1ccc(Cl)c(OCC(=O)Nc2ccccc2C(C)C)c1.
What is the InChIKey of 2-(2-chloro-5-methylphenoxy)-N-(2-propan-2-ylphenyl)acetamide?
The InChIKey is GARSRRWWHBZFFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20ClNO2/c1-12(2)14-6-4-5-7-16(14)20-18(21)11-22-17-10-13(3)8-9-15(17)19/h4-10,12H,11H2,1-3H3,(H,20,21).
What are the key properties of 2-(2-chloro-5-methylphenoxy)-N-(2-propan-2-ylphenyl)acetamide?
2-(2-chloro-5-methylphenoxy)-N-(2-propan-2-ylphenyl)acetamide has a molecular weight of 317.82 g/mol, XLogP of 4.79, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-5-methylphenoxy)-N-(2-propan-2-ylphenyl)acetamide is sourced from PubChem (CID 7642804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).