N-[2-(3-methoxyphenoxy)ethyl]-2-(4-methylphenoxy)acetamide

C18H21NO4 — CID 113099802

IUPACN-[2-(3-methoxyphenoxy)ethyl]-2-(4-methylphenoxy)acetamide
SMILESCOc1cccc(OCCNC(=O)COc2ccc(C)cc2)c1
InChIInChI=1S/C18H21NO4/c1-14-6-8-15(9-7-14)23-13-18(20)19-10-11-22-17-5-3-4-16(12-17)21-2/h3-9,12H,10-11,13H2,1-2H3,(H,19,20)
InChIKeyGKMZHGSYEWNOHV-UHFFFAOYSA-N
MW315.37 g/mol
LogP2.58
Rot. Bonds8

About N-[2-(3-methoxyphenoxy)ethyl]-2-(4-methylphenoxy)acetamide

N-[2-(3-methoxyphenoxy)ethyl]-2-(4-methylphenoxy)acetamide (PubChem CID 113099802) has the molecular formula C18H21NO4 and a molecular weight of 315.37 g/mol. Its IUPAC name is N-[2-(3-methoxyphenoxy)ethyl]-2-(4-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-[2-(3-methoxyphenoxy)ethyl]-2-(4-methylphenoxy)acetamide
PubChem CID113099802
Molecular FormulaC18H21NO4
Molecular Weight315.37 g/mol
Exact Mass315.15
IUPAC NameN-[2-(3-methoxyphenoxy)ethyl]-2-(4-methylphenoxy)acetamide
SMILESCOc1cccc(OCCNC(=O)COc2ccc(C)cc2)c1
InChIInChI=1S/C18H21NO4/c1-14-6-8-15(9-7-14)23-13-18(20)19-10-11-22-17-5-3-4-16(12-17)21-2/h3-9,12H,10-11,13H2,1-2H3,(H,19,20)
InChIKeyGKMZHGSYEWNOHV-UHFFFAOYSA-N
XLogP2.58
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.37
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(4-methoxyphenoxy)ethyl]-2-(3-methylphenoxy)acetamide
CID 8935101
2-(4-methoxyphenoxy)-N-(2-phenoxyethyl)acetamide
CID 2265793
N-[2-(4-methoxyphenoxy)ethyl]-2-phenoxyacetamide
CID 17468348
3-methoxy-N-[2-(4-methylphenoxy)ethyl]benzamide
CID 7761263
N-[2-(3-methoxyphenoxy)ethyl]-3-phenoxypropanamide
CID 113099798
N-[2-(3-methoxyphenoxy)ethyl]-2-(4-methoxyphenyl)acetamide
CID 46399940
N-[2-(4-methylphenoxy)ethyl]-2-(3-methyl-4-propan-2-ylphenoxy)acetamide
CID 19174758
2-(3-methylphenoxy)-N-[3-(3-methylphenoxy)propyl]acetamide
CID 24533364
2-(3-methoxyphenoxy)-N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]acetamide
CID 94870746
2-(3-butoxyphenoxy)-N-(2-methoxyethyl)acetamide
CID 4733178
N-[2-(3,5-dimethylphenoxy)ethyl]-2-phenoxyacetamide
CID 19173987
methyl 3-[[2-(3-methoxyphenoxy)acetyl]amino]propanoate
CID 82018109

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-methoxyphenoxy)ethyl]-2-(4-methylphenoxy)acetamide?
The IUPAC name of N-[2-(3-methoxyphenoxy)ethyl]-2-(4-methylphenoxy)acetamide (CID 113099802) is N-[2-(3-methoxyphenoxy)ethyl]-2-(4-methylphenoxy)acetamide.
What is the SMILES notation for N-[2-(3-methoxyphenoxy)ethyl]-2-(4-methylphenoxy)acetamide?
The canonical SMILES for N-[2-(3-methoxyphenoxy)ethyl]-2-(4-methylphenoxy)acetamide is COc1cccc(OCCNC(=O)COc2ccc(C)cc2)c1.
What is the InChIKey of N-[2-(3-methoxyphenoxy)ethyl]-2-(4-methylphenoxy)acetamide?
The InChIKey is GKMZHGSYEWNOHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO4/c1-14-6-8-15(9-7-14)23-13-18(20)19-10-11-22-17-5-3-4-16(12-17)21-2/h3-9,12H,10-11,13H2,1-2H3,(H,19,20).
What are the key properties of N-[2-(3-methoxyphenoxy)ethyl]-2-(4-methylphenoxy)acetamide?
N-[2-(3-methoxyphenoxy)ethyl]-2-(4-methylphenoxy)acetamide has a molecular weight of 315.37 g/mol, XLogP of 2.58, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-methoxyphenoxy)ethyl]-2-(4-methylphenoxy)acetamide is sourced from PubChem (CID 113099802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).