N-(4-ethoxyphenyl)-2-(2-phenoxyethoxy)benzamide

C23H23NO4 — CID 4954273

IUPACN-(4-ethoxyphenyl)-2-(2-phenoxyethoxy)benzamide
SMILESCCOc1ccc(NC(=O)c2ccccc2OCCOc2ccccc2)cc1
InChIInChI=1S/C23H23NO4/c1-2-26-20-14-12-18(13-15-20)24-23(25)21-10-6-7-11-22(21)28-17-16-27-19-8-4-3-5-9-19/h3-15H,2,16-17H2,1H3,(H,24,25)
InChIKeyUZHPRLUCTMVYKX-UHFFFAOYSA-N
MW377.44 g/mol
LogP4.80
Rot. Bonds9

About N-(4-ethoxyphenyl)-2-(2-phenoxyethoxy)benzamide

N-(4-ethoxyphenyl)-2-(2-phenoxyethoxy)benzamide (PubChem CID 4954273) has the molecular formula C23H23NO4 and a molecular weight of 377.44 g/mol. Its IUPAC name is N-(4-ethoxyphenyl)-2-(2-phenoxyethoxy)benzamide.

Molecular Properties

Compound NameN-(4-ethoxyphenyl)-2-(2-phenoxyethoxy)benzamide
PubChem CID4954273
Molecular FormulaC23H23NO4
Molecular Weight377.44 g/mol
Exact Mass377.16
IUPAC NameN-(4-ethoxyphenyl)-2-(2-phenoxyethoxy)benzamide
SMILESCCOc1ccc(NC(=O)c2ccccc2OCCOc2ccccc2)cc1
InChIInChI=1S/C23H23NO4/c1-2-26-20-14-12-18(13-15-20)24-23(25)21-10-6-7-11-22(21)28-17-16-27-19-8-4-3-5-9-19/h3-15H,2,16-17H2,1H3,(H,24,25)
InChIKeyUZHPRLUCTMVYKX-UHFFFAOYSA-N
XLogP4.80
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.44
LogP ≤ 54.80
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-(4-ethoxyphenyl)-2-(2-phenoxyethoxy)benzamide?
The IUPAC name of N-(4-ethoxyphenyl)-2-(2-phenoxyethoxy)benzamide (CID 4954273) is N-(4-ethoxyphenyl)-2-(2-phenoxyethoxy)benzamide.
What is the SMILES notation for N-(4-ethoxyphenyl)-2-(2-phenoxyethoxy)benzamide?
The canonical SMILES for N-(4-ethoxyphenyl)-2-(2-phenoxyethoxy)benzamide is CCOc1ccc(NC(=O)c2ccccc2OCCOc2ccccc2)cc1.
What is the InChIKey of N-(4-ethoxyphenyl)-2-(2-phenoxyethoxy)benzamide?
The InChIKey is UZHPRLUCTMVYKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23NO4/c1-2-26-20-14-12-18(13-15-20)24-23(25)21-10-6-7-11-22(21)28-17-16-27-19-8-4-3-5-9-19/h3-15H,2,16-17H2,1H3,(H,24,25).
What are the key properties of N-(4-ethoxyphenyl)-2-(2-phenoxyethoxy)benzamide?
N-(4-ethoxyphenyl)-2-(2-phenoxyethoxy)benzamide has a molecular weight of 377.44 g/mol, XLogP of 4.80, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxyphenyl)-2-(2-phenoxyethoxy)benzamide is sourced from PubChem (CID 4954273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).