N-(4-acetamidophenyl)-2-(2-chloro-5-methylphenoxy)acetamide

C17H17ClN2O3 — CID 7731856

IUPACN-(4-acetamidophenyl)-2-(2-chloro-5-methylphenoxy)acetamide
SMILESCC(=O)Nc1ccc(NC(=O)COc2cc(C)ccc2Cl)cc1
InChIInChI=1S/C17H17ClN2O3/c1-11-3-8-15(18)16(9-11)23-10-17(22)20-14-6-4-13(5-7-14)19-12(2)21/h3-9H,10H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyFNUMYWUMKBXRRN-UHFFFAOYSA-N
MW332.79 g/mol
LogP3.62
Rot. Bonds5

About N-(4-acetamidophenyl)-2-(2-chloro-5-methylphenoxy)acetamide

N-(4-acetamidophenyl)-2-(2-chloro-5-methylphenoxy)acetamide (PubChem CID 7731856) has the molecular formula C17H17ClN2O3 and a molecular weight of 332.79 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-2-(2-chloro-5-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-2-(2-chloro-5-methylphenoxy)acetamide
PubChem CID7731856
Molecular FormulaC17H17ClN2O3
Molecular Weight332.79 g/mol
Exact Mass332.09
IUPAC NameN-(4-acetamidophenyl)-2-(2-chloro-5-methylphenoxy)acetamide
SMILESCC(=O)Nc1ccc(NC(=O)COc2cc(C)ccc2Cl)cc1
InChIInChI=1S/C17H17ClN2O3/c1-11-3-8-15(18)16(9-11)23-10-17(22)20-14-6-4-13(5-7-14)19-12(2)21/h3-9H,10H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyFNUMYWUMKBXRRN-UHFFFAOYSA-N
XLogP3.62
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.79
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-chloro-5-methylphenoxy)-N-(3,4-dimethylphenyl)acetamide
CID 7642767
2-(2-chloro-5-methylphenoxy)-N-(4-cyanophenyl)acetamide
CID 7642831
2-(2-chloro-5-methylphenoxy)-N-(4-phenoxyphenyl)acetamide
CID 7917293
4-[[2-(2-chloro-5-methylphenoxy)acetyl]amino]-N,N-diethylbenzamide
CID 8503681
N-(4-acetamidophenyl)-2-(2,4-dichlorophenoxy)acetamide
CID 1039828
N-(4-acetylphenyl)-2-(2,4,5-trichlorophenoxy)acetamide
CID 1047129
2-(2-chloro-5-methylphenoxy)-N-(2-chlorophenyl)acetamide
CID 2611371
methyl 4-[[2-[2-(2-chloro-5-methylphenoxy)acetyl]oxyacetyl]amino]benzoate
CID 7570532
N-(4-acetylphenyl)-2-(2,5-dichlorophenoxy)acetamide
CID 724281
2-(2-chloro-4-fluorophenoxy)-N-(4-methylphenyl)acetamide
CID 9402450
2-(2,3-dichlorophenoxy)-N-(4-methylphenyl)acetamide
CID 2602907
N-(4-aminophenyl)-2-(2,4,5-trichlorophenoxy)acetamide
CID 29274448

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-2-(2-chloro-5-methylphenoxy)acetamide?
The IUPAC name of N-(4-acetamidophenyl)-2-(2-chloro-5-methylphenoxy)acetamide (CID 7731856) is N-(4-acetamidophenyl)-2-(2-chloro-5-methylphenoxy)acetamide.
What is the SMILES notation for N-(4-acetamidophenyl)-2-(2-chloro-5-methylphenoxy)acetamide?
The canonical SMILES for N-(4-acetamidophenyl)-2-(2-chloro-5-methylphenoxy)acetamide is CC(=O)Nc1ccc(NC(=O)COc2cc(C)ccc2Cl)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-2-(2-chloro-5-methylphenoxy)acetamide?
The InChIKey is FNUMYWUMKBXRRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17ClN2O3/c1-11-3-8-15(18)16(9-11)23-10-17(22)20-14-6-4-13(5-7-14)19-12(2)21/h3-9H,10H2,1-2H3,(H,19,21)(H,20,22).
What are the key properties of N-(4-acetamidophenyl)-2-(2-chloro-5-methylphenoxy)acetamide?
N-(4-acetamidophenyl)-2-(2-chloro-5-methylphenoxy)acetamide has a molecular weight of 332.79 g/mol, XLogP of 3.62, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-2-(2-chloro-5-methylphenoxy)acetamide is sourced from PubChem (CID 7731856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).