N-[2-(4-methoxyphenoxy)ethyl]-2-(2-methoxyphenyl)acetamide

C18H21NO4 — CID 18119172

IUPACN-[2-(4-methoxyphenoxy)ethyl]-2-(2-methoxyphenyl)acetamide
SMILESCOc1ccc(OCCNC(=O)Cc2ccccc2OC)cc1
InChIInChI=1S/C18H21NO4/c1-21-15-7-9-16(10-8-15)23-12-11-19-18(20)13-14-5-3-4-6-17(14)22-2/h3-10H,11-13H2,1-2H3,(H,19,20)
InChIKeyVERNJAHGXFUPFK-UHFFFAOYSA-N
MW315.37 g/mol
LogP2.44
Rot. Bonds8

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

N-[2-(4-methoxyphenoxy)ethyl]-2-(2-methoxyphenyl)acetamide (PubChem CID 18119172) has the molecular formula C18H21NO4 and a molecular weight of 315.37 g/mol. Its IUPAC name is N-[2-(4-methoxyphenoxy)ethyl]-2-(2-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-[2-(4-methoxyphenoxy)ethyl]-2-(2-methoxyphenyl)acetamide
PubChem CID18119172
Molecular FormulaC18H21NO4
Molecular Weight315.37 g/mol
Exact Mass315.15
IUPAC NameN-[2-(4-methoxyphenoxy)ethyl]-2-(2-methoxyphenyl)acetamide
SMILESCOc1ccc(OCCNC(=O)Cc2ccccc2OC)cc1
InChIInChI=1S/C18H21NO4/c1-21-15-7-9-16(10-8-15)23-12-11-19-18(20)13-14-5-3-4-6-17(14)22-2/h3-10H,11-13H2,1-2H3,(H,19,20)
InChIKeyVERNJAHGXFUPFK-UHFFFAOYSA-N
XLogP2.44
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 ≤ 52.44
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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Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methoxyphenoxy)ethyl]-2-(2-methoxyphenyl)acetamide?
The IUPAC name of N-[2-(4-methoxyphenoxy)ethyl]-2-(2-methoxyphenyl)acetamide (CID 18119172) is N-[2-(4-methoxyphenoxy)ethyl]-2-(2-methoxyphenyl)acetamide.
What is the SMILES notation for N-[2-(4-methoxyphenoxy)ethyl]-2-(2-methoxyphenyl)acetamide?
The canonical SMILES for N-[2-(4-methoxyphenoxy)ethyl]-2-(2-methoxyphenyl)acetamide is COc1ccc(OCCNC(=O)Cc2ccccc2OC)cc1.
What is the InChIKey of N-[2-(4-methoxyphenoxy)ethyl]-2-(2-methoxyphenyl)acetamide?
The InChIKey is VERNJAHGXFUPFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO4/c1-21-15-7-9-16(10-8-15)23-12-11-19-18(20)13-14-5-3-4-6-17(14)22-2/h3-10H,11-13H2,1-2H3,(H,19,20).
What are the key properties of N-[2-(4-methoxyphenoxy)ethyl]-2-(2-methoxyphenyl)acetamide?
N-[2-(4-methoxyphenoxy)ethyl]-2-(2-methoxyphenyl)acetamide has a molecular weight of 315.37 g/mol, XLogP of 2.44, 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-(2-methoxyphenyl)acetamide is sourced from PubChem (CID 18119172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).