2-(2-ethoxyanilino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide

C24H26N2O4 — CID 54817274

IUPAC2-(2-ethoxyanilino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide
SMILESCCOc1ccccc1NCC(=O)Nc1ccccc1OCCOc1ccccc1
InChIInChI=1S/C24H26N2O4/c1-2-28-22-14-8-6-12-20(22)25-18-24(27)26-21-13-7-9-15-23(21)30-17-16-29-19-10-4-3-5-11-19/h3-15,25H,2,16-18H2,1H3,(H,26,27)
InChIKeyATDDPQATSQUZCR-UHFFFAOYSA-N
MW406.48 g/mol
LogP4.59
Rot. Bonds11

About 2-(2-ethoxyanilino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide

2-(2-ethoxyanilino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide (PubChem CID 54817274) has the molecular formula C24H26N2O4 and a molecular weight of 406.48 g/mol. Its IUPAC name is 2-(2-ethoxyanilino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-(2-ethoxyanilino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide
PubChem CID54817274
Molecular FormulaC24H26N2O4
Molecular Weight406.48 g/mol
Exact Mass406.19
IUPAC Name2-(2-ethoxyanilino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide
SMILESCCOc1ccccc1NCC(=O)Nc1ccccc1OCCOc1ccccc1
InChIInChI=1S/C24H26N2O4/c1-2-28-22-14-8-6-12-20(22)25-18-24(27)26-21-13-7-9-15-23(21)30-17-16-29-19-10-4-3-5-11-19/h3-15,25H,2,16-18H2,1H3,(H,26,27)
InChIKeyATDDPQATSQUZCR-UHFFFAOYSA-N
XLogP4.59
TPSA68.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.48
LogP ≤ 54.59
H-Bond Donors ≤ 52
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 2-(2-ethoxyanilino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide?
The IUPAC name of 2-(2-ethoxyanilino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide (CID 54817274) is 2-(2-ethoxyanilino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide.
What is the SMILES notation for 2-(2-ethoxyanilino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide?
The canonical SMILES for 2-(2-ethoxyanilino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide is CCOc1ccccc1NCC(=O)Nc1ccccc1OCCOc1ccccc1.
What is the InChIKey of 2-(2-ethoxyanilino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide?
The InChIKey is ATDDPQATSQUZCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O4/c1-2-28-22-14-8-6-12-20(22)25-18-24(27)26-21-13-7-9-15-23(21)30-17-16-29-19-10-4-3-5-11-19/h3-15,25H,2,16-18H2,1H3,(H,26,27).
What are the key properties of 2-(2-ethoxyanilino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide?
2-(2-ethoxyanilino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide has a molecular weight of 406.48 g/mol, XLogP of 4.59, 11 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxyanilino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide is sourced from PubChem (CID 54817274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).