2-(2-methoxyethoxy)-N-[2-(4-methylphenoxy)phenyl]benzamide

C23H23NO4 — CID 60567369

IUPAC2-(2-methoxyethoxy)-N-[2-(4-methylphenoxy)phenyl]benzamide
SMILESCOCCOc1ccccc1C(=O)Nc1ccccc1Oc1ccc(C)cc1
InChIInChI=1S/C23H23NO4/c1-17-11-13-18(14-12-17)28-22-10-6-4-8-20(22)24-23(25)19-7-3-5-9-21(19)27-16-15-26-2/h3-14H,15-16H2,1-2H3,(H,24,25)
InChIKeyLBVXLVHYHSUXOY-UHFFFAOYSA-N
MW377.44 g/mol
LogP5.06
Rot. Bonds8

About 2-(2-methoxyethoxy)-N-[2-(4-methylphenoxy)phenyl]benzamide

2-(2-methoxyethoxy)-N-[2-(4-methylphenoxy)phenyl]benzamide (PubChem CID 60567369) has the molecular formula C23H23NO4 and a molecular weight of 377.44 g/mol. Its IUPAC name is 2-(2-methoxyethoxy)-N-[2-(4-methylphenoxy)phenyl]benzamide.

Molecular Properties

Compound Name2-(2-methoxyethoxy)-N-[2-(4-methylphenoxy)phenyl]benzamide
PubChem CID60567369
Molecular FormulaC23H23NO4
Molecular Weight377.44 g/mol
Exact Mass377.16
IUPAC Name2-(2-methoxyethoxy)-N-[2-(4-methylphenoxy)phenyl]benzamide
SMILESCOCCOc1ccccc1C(=O)Nc1ccccc1Oc1ccc(C)cc1
InChIInChI=1S/C23H23NO4/c1-17-11-13-18(14-12-17)28-22-10-6-4-8-20(22)24-23(25)19-7-3-5-9-21(19)27-16-15-26-2/h3-14H,15-16H2,1-2H3,(H,24,25)
InChIKeyLBVXLVHYHSUXOY-UHFFFAOYSA-N
XLogP5.06
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms28
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500377.44
LogP ≤ 55.06
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 2-(2-methoxyethoxy)-N-[2-(4-methylphenoxy)phenyl]benzamide?
The IUPAC name of 2-(2-methoxyethoxy)-N-[2-(4-methylphenoxy)phenyl]benzamide (CID 60567369) is 2-(2-methoxyethoxy)-N-[2-(4-methylphenoxy)phenyl]benzamide.
What is the SMILES notation for 2-(2-methoxyethoxy)-N-[2-(4-methylphenoxy)phenyl]benzamide?
The canonical SMILES for 2-(2-methoxyethoxy)-N-[2-(4-methylphenoxy)phenyl]benzamide is COCCOc1ccccc1C(=O)Nc1ccccc1Oc1ccc(C)cc1.
What is the InChIKey of 2-(2-methoxyethoxy)-N-[2-(4-methylphenoxy)phenyl]benzamide?
The InChIKey is LBVXLVHYHSUXOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23NO4/c1-17-11-13-18(14-12-17)28-22-10-6-4-8-20(22)24-23(25)19-7-3-5-9-21(19)27-16-15-26-2/h3-14H,15-16H2,1-2H3,(H,24,25).
What are the key properties of 2-(2-methoxyethoxy)-N-[2-(4-methylphenoxy)phenyl]benzamide?
2-(2-methoxyethoxy)-N-[2-(4-methylphenoxy)phenyl]benzamide has a molecular weight of 377.44 g/mol, XLogP of 5.06, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethoxy)-N-[2-(4-methylphenoxy)phenyl]benzamide is sourced from PubChem (CID 60567369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).