N-(2-ethoxyphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide

C24H26N2O4 — CID 54827090

IUPACN-(2-ethoxyphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide
SMILESCCOc1ccccc1NC(=O)CNc1ccccc1OCCOc1ccccc1
InChIInChI=1S/C24H26N2O4/c1-2-28-23-15-9-7-13-21(23)26-24(27)18-25-20-12-6-8-14-22(20)30-17-16-29-19-10-4-3-5-11-19/h3-15,25H,2,16-18H2,1H3,(H,26,27)
InChIKeyZIKZSVGURRMMIR-UHFFFAOYSA-N
MW406.48 g/mol
LogP4.59
Rot. Bonds11

About N-(2-ethoxyphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide

N-(2-ethoxyphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide (PubChem CID 54827090) has the molecular formula C24H26N2O4 and a molecular weight of 406.48 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide
PubChem CID54827090
Molecular FormulaC24H26N2O4
Molecular Weight406.48 g/mol
Exact Mass406.19
IUPAC NameN-(2-ethoxyphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide
SMILESCCOc1ccccc1NC(=O)CNc1ccccc1OCCOc1ccccc1
InChIInChI=1S/C24H26N2O4/c1-2-28-23-15-9-7-13-21(23)26-24(27)18-25-20-12-6-8-14-22(20)30-17-16-29-19-10-4-3-5-11-19/h3-15,25H,2,16-18H2,1H3,(H,26,27)
InChIKeyZIKZSVGURRMMIR-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 N-(2-ethoxyphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide?
The IUPAC name of N-(2-ethoxyphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide (CID 54827090) is N-(2-ethoxyphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide?
The canonical SMILES for N-(2-ethoxyphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide is CCOc1ccccc1NC(=O)CNc1ccccc1OCCOc1ccccc1.
What is the InChIKey of N-(2-ethoxyphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide?
The InChIKey is ZIKZSVGURRMMIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O4/c1-2-28-23-15-9-7-13-21(23)26-24(27)18-25-20-12-6-8-14-22(20)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 N-(2-ethoxyphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide?
N-(2-ethoxyphenyl)-2-[2-(2-phenoxyethoxy)anilino]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 N-(2-ethoxyphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide is sourced from PubChem (CID 54827090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).