2-(4-chlorophenoxy)-N-[4-(2-methoxyethylamino)phenyl]acetamide

C17H19ClN2O3 — CID 112980930

IUPAC2-(4-chlorophenoxy)-N-[4-(2-methoxyethylamino)phenyl]acetamide
SMILESCOCCNc1ccc(NC(=O)COc2ccc(Cl)cc2)cc1
InChIInChI=1S/C17H19ClN2O3/c1-22-11-10-19-14-4-6-15(7-5-14)20-17(21)12-23-16-8-2-13(18)3-9-16/h2-9,19H,10-12H2,1H3,(H,20,21)
InChIKeyPONPTNXRYOVDSG-UHFFFAOYSA-N
MW334.80 g/mol
LogP3.42
Rot. Bonds8

About 2-(4-chlorophenoxy)-N-[4-(2-methoxyethylamino)phenyl]acetamide

2-(4-chlorophenoxy)-N-[4-(2-methoxyethylamino)phenyl]acetamide (PubChem CID 112980930) has the molecular formula C17H19ClN2O3 and a molecular weight of 334.80 g/mol. Its IUPAC name is 2-(4-chlorophenoxy)-N-[4-(2-methoxyethylamino)phenyl]acetamide.

Molecular Properties

Compound Name2-(4-chlorophenoxy)-N-[4-(2-methoxyethylamino)phenyl]acetamide
PubChem CID112980930
Molecular FormulaC17H19ClN2O3
Molecular Weight334.80 g/mol
Exact Mass334.11
IUPAC Name2-(4-chlorophenoxy)-N-[4-(2-methoxyethylamino)phenyl]acetamide
SMILESCOCCNc1ccc(NC(=O)COc2ccc(Cl)cc2)cc1
InChIInChI=1S/C17H19ClN2O3/c1-22-11-10-19-14-4-6-15(7-5-14)20-17(21)12-23-16-8-2-13(18)3-9-16/h2-9,19H,10-12H2,1H3,(H,20,21)
InChIKeyPONPTNXRYOVDSG-UHFFFAOYSA-N
XLogP3.42
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.80
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(4-chlorophenoxy)-N-[4-[2-(dimethylamino)ethylamino]phenyl]acetamide
CID 112981318
N-(4-chlorophenyl)-2-[4-(2-methoxyethoxy)anilino]acetamide
CID 54822618
N-[4-[2-(4-chlorophenyl)ethylamino]phenyl]-2-phenoxyacetamide
CID 112984120
N-[4-[[2-(4-chlorophenoxy)acetyl]amino]phenyl]-2,2,2-trifluoroacetamide
CID 112505285
N-(4-chlorophenyl)-3-(4-methoxyanilino)propanamide
CID 109038116
N-[4-[2-(4-chloroanilino)-2-oxoethoxy]phenyl]-2-methoxybenzamide
CID 18227530
N-[4-[(4-chlorophenyl)methylamino]phenyl]-2-phenoxyacetamide
CID 112982593
2-[4-[(4-chloroanilino)methyl]phenoxy]-N-(3-chloro-4-methylphenyl)acetamide
CID 126272760
methyl 4-[2-(4-chloroanilino)ethoxy]benzoate
CID 15086593
2-(4-chlorophenoxy)-N-pyridin-4-ylacetamide;hydrochloride
CID 163329233
2-(4-acetamidophenoxy)-N-(4-acetamidophenyl)acetamide
CID 7203623
2-(4-chlorophenoxy)-N-(2-methoxypyrimidin-5-yl)acetamide
CID 91968336

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenoxy)-N-[4-(2-methoxyethylamino)phenyl]acetamide?
The IUPAC name of 2-(4-chlorophenoxy)-N-[4-(2-methoxyethylamino)phenyl]acetamide (CID 112980930) is 2-(4-chlorophenoxy)-N-[4-(2-methoxyethylamino)phenyl]acetamide.
What is the SMILES notation for 2-(4-chlorophenoxy)-N-[4-(2-methoxyethylamino)phenyl]acetamide?
The canonical SMILES for 2-(4-chlorophenoxy)-N-[4-(2-methoxyethylamino)phenyl]acetamide is COCCNc1ccc(NC(=O)COc2ccc(Cl)cc2)cc1.
What is the InChIKey of 2-(4-chlorophenoxy)-N-[4-(2-methoxyethylamino)phenyl]acetamide?
The InChIKey is PONPTNXRYOVDSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClN2O3/c1-22-11-10-19-14-4-6-15(7-5-14)20-17(21)12-23-16-8-2-13(18)3-9-16/h2-9,19H,10-12H2,1H3,(H,20,21).
What are the key properties of 2-(4-chlorophenoxy)-N-[4-(2-methoxyethylamino)phenyl]acetamide?
2-(4-chlorophenoxy)-N-[4-(2-methoxyethylamino)phenyl]acetamide has a molecular weight of 334.80 g/mol, XLogP of 3.42, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenoxy)-N-[4-(2-methoxyethylamino)phenyl]acetamide is sourced from PubChem (CID 112980930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).