N-[4-(2-ethoxyethoxy)phenyl]-2-(2-methoxyphenoxy)acetamide

C19H23NO5 — CID 17130561

IUPACN-[4-(2-ethoxyethoxy)phenyl]-2-(2-methoxyphenoxy)acetamide
SMILESCCOCCOc1ccc(NC(=O)COc2ccccc2OC)cc1
InChIInChI=1S/C19H23NO5/c1-3-23-12-13-24-16-10-8-15(9-11-16)20-19(21)14-25-18-7-5-4-6-17(18)22-2/h4-11H,3,12-14H2,1-2H3,(H,20,21)
InChIKeyISBTYYCPKNRPHU-UHFFFAOYSA-N
MW345.40 g/mol
LogP3.13
Rot. Bonds10

About N-[4-(2-ethoxyethoxy)phenyl]-2-(2-methoxyphenoxy)acetamide

N-[4-(2-ethoxyethoxy)phenyl]-2-(2-methoxyphenoxy)acetamide (PubChem CID 17130561) has the molecular formula C19H23NO5 and a molecular weight of 345.40 g/mol. Its IUPAC name is N-[4-(2-ethoxyethoxy)phenyl]-2-(2-methoxyphenoxy)acetamide.

Molecular Properties

Compound NameN-[4-(2-ethoxyethoxy)phenyl]-2-(2-methoxyphenoxy)acetamide
PubChem CID17130561
Molecular FormulaC19H23NO5
Molecular Weight345.40 g/mol
Exact Mass345.16
IUPAC NameN-[4-(2-ethoxyethoxy)phenyl]-2-(2-methoxyphenoxy)acetamide
SMILESCCOCCOc1ccc(NC(=O)COc2ccccc2OC)cc1
InChIInChI=1S/C19H23NO5/c1-3-23-12-13-24-16-10-8-15(9-11-16)20-19(21)14-25-18-7-5-4-6-17(18)22-2/h4-11H,3,12-14H2,1-2H3,(H,20,21)
InChIKeyISBTYYCPKNRPHU-UHFFFAOYSA-N
XLogP3.13
TPSA66.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.40
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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-[4-(2-ethoxyethoxy)phenyl]-2-(2-methoxyphenoxy)acetamide?
The IUPAC name of N-[4-(2-ethoxyethoxy)phenyl]-2-(2-methoxyphenoxy)acetamide (CID 17130561) is N-[4-(2-ethoxyethoxy)phenyl]-2-(2-methoxyphenoxy)acetamide.
What is the SMILES notation for N-[4-(2-ethoxyethoxy)phenyl]-2-(2-methoxyphenoxy)acetamide?
The canonical SMILES for N-[4-(2-ethoxyethoxy)phenyl]-2-(2-methoxyphenoxy)acetamide is CCOCCOc1ccc(NC(=O)COc2ccccc2OC)cc1.
What is the InChIKey of N-[4-(2-ethoxyethoxy)phenyl]-2-(2-methoxyphenoxy)acetamide?
The InChIKey is ISBTYYCPKNRPHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO5/c1-3-23-12-13-24-16-10-8-15(9-11-16)20-19(21)14-25-18-7-5-4-6-17(18)22-2/h4-11H,3,12-14H2,1-2H3,(H,20,21).
What are the key properties of N-[4-(2-ethoxyethoxy)phenyl]-2-(2-methoxyphenoxy)acetamide?
N-[4-(2-ethoxyethoxy)phenyl]-2-(2-methoxyphenoxy)acetamide has a molecular weight of 345.40 g/mol, XLogP of 3.13, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-ethoxyethoxy)phenyl]-2-(2-methoxyphenoxy)acetamide is sourced from PubChem (CID 17130561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).