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

C18H21NO4 — CID 8935101

IUPACN-[2-(4-methoxyphenoxy)ethyl]-2-(3-methylphenoxy)acetamide
SMILESCOc1ccc(OCCNC(=O)COc2cccc(C)c2)cc1
InChIInChI=1S/C18H21NO4/c1-14-4-3-5-17(12-14)23-13-18(20)19-10-11-22-16-8-6-15(21-2)7-9-16/h3-9,12H,10-11,13H2,1-2H3,(H,19,20)
InChIKeyRISHRTLHFPPIBF-UHFFFAOYSA-N
MW315.37 g/mol
LogP2.58
Rot. Bonds8

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

N-[2-(4-methoxyphenoxy)ethyl]-2-(3-methylphenoxy)acetamide (PubChem CID 8935101) has the molecular formula C18H21NO4 and a molecular weight of 315.37 g/mol. Its IUPAC name is N-[2-(4-methoxyphenoxy)ethyl]-2-(3-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-[2-(4-methoxyphenoxy)ethyl]-2-(3-methylphenoxy)acetamide
PubChem CID8935101
Molecular FormulaC18H21NO4
Molecular Weight315.37 g/mol
Exact Mass315.15
IUPAC NameN-[2-(4-methoxyphenoxy)ethyl]-2-(3-methylphenoxy)acetamide
SMILESCOc1ccc(OCCNC(=O)COc2cccc(C)c2)cc1
InChIInChI=1S/C18H21NO4/c1-14-4-3-5-17(12-14)23-13-18(20)19-10-11-22-16-8-6-15(21-2)7-9-16/h3-9,12H,10-11,13H2,1-2H3,(H,19,20)
InChIKeyRISHRTLHFPPIBF-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-(3-methoxyphenoxy)ethyl]-2-(4-methylphenoxy)acetamide
CID 113099802
2-(3-methylphenoxy)-N-[3-(3-methylphenoxy)propyl]acetamide
CID 24533364
2-(4-methoxyphenoxy)-N-(2-phenoxyethyl)acetamide
CID 2265793
N-[2-(4-methoxyphenoxy)ethyl]-2-phenoxyacetamide
CID 17468348
2-(3-cyanophenoxy)-N-[2-(3-methylphenoxy)ethyl]acetamide
CID 9457314
2-[(6-iodo-3-pyridinyl)oxy]-N-[2-(3-methylphenoxy)ethyl]acetamide
CID 71849880
N-[2-(3,5-dimethylphenoxy)ethyl]-2-phenoxyacetamide
CID 19173987
2-(3-methyl-4-nitrophenoxy)-N-[2-(3-methylphenoxy)ethyl]acetamide
CID 31880593
N-[3-(3-methoxyphenyl)propyl]-2-(3-methylphenoxy)acetamide
CID 95172598
4-methyl-2-[2-[2-(3-methylphenoxy)ethylamino]-2-oxoethoxy]benzamide
CID 17422361
2-(2-bromo-4-methylphenoxy)-N-[2-(3-methylphenoxy)ethyl]acetamide
CID 9372061
1-methoxy-4-[2-(3-methylphenoxy)ethoxy]benzene
CID 14047829

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methoxyphenoxy)ethyl]-2-(3-methylphenoxy)acetamide?
The IUPAC name of N-[2-(4-methoxyphenoxy)ethyl]-2-(3-methylphenoxy)acetamide (CID 8935101) is N-[2-(4-methoxyphenoxy)ethyl]-2-(3-methylphenoxy)acetamide.
What is the SMILES notation for N-[2-(4-methoxyphenoxy)ethyl]-2-(3-methylphenoxy)acetamide?
The canonical SMILES for N-[2-(4-methoxyphenoxy)ethyl]-2-(3-methylphenoxy)acetamide is COc1ccc(OCCNC(=O)COc2cccc(C)c2)cc1.
What is the InChIKey of N-[2-(4-methoxyphenoxy)ethyl]-2-(3-methylphenoxy)acetamide?
The InChIKey is RISHRTLHFPPIBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO4/c1-14-4-3-5-17(12-14)23-13-18(20)19-10-11-22-16-8-6-15(21-2)7-9-16/h3-9,12H,10-11,13H2,1-2H3,(H,19,20).
What are the key properties of N-[2-(4-methoxyphenoxy)ethyl]-2-(3-methylphenoxy)acetamide?
N-[2-(4-methoxyphenoxy)ethyl]-2-(3-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-(4-methoxyphenoxy)ethyl]-2-(3-methylphenoxy)acetamide is sourced from PubChem (CID 8935101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).