2-(2-ethoxyethoxy)-N-[3-(furan-2-ylmethylcarbamoyl)phenyl]benzamide

C23H24N2O5 — CID 17200047

IUPAC2-(2-ethoxyethoxy)-N-[3-(furan-2-ylmethylcarbamoyl)phenyl]benzamide
SMILESCCOCCOc1ccccc1C(=O)Nc1cccc(C(=O)NCc2ccco2)c1
InChIInChI=1S/C23H24N2O5/c1-2-28-13-14-30-21-11-4-3-10-20(21)23(27)25-18-8-5-7-17(15-18)22(26)24-16-19-9-6-12-29-19/h3-12,15H,2,13-14,16H2,1H3,(H,24,26)(H,25,27)
InChIKeyVZNWAPCNFGJVLP-UHFFFAOYSA-N
MW408.45 g/mol
LogP3.88
Rot. Bonds10

About 2-(2-ethoxyethoxy)-N-[3-(furan-2-ylmethylcarbamoyl)phenyl]benzamide

2-(2-ethoxyethoxy)-N-[3-(furan-2-ylmethylcarbamoyl)phenyl]benzamide (PubChem CID 17200047) has the molecular formula C23H24N2O5 and a molecular weight of 408.45 g/mol. Its IUPAC name is 2-(2-ethoxyethoxy)-N-[3-(furan-2-ylmethylcarbamoyl)phenyl]benzamide.

Molecular Properties

Compound Name2-(2-ethoxyethoxy)-N-[3-(furan-2-ylmethylcarbamoyl)phenyl]benzamide
PubChem CID17200047
Molecular FormulaC23H24N2O5
Molecular Weight408.45 g/mol
Exact Mass408.17
IUPAC Name2-(2-ethoxyethoxy)-N-[3-(furan-2-ylmethylcarbamoyl)phenyl]benzamide
SMILESCCOCCOc1ccccc1C(=O)Nc1cccc(C(=O)NCc2ccco2)c1
InChIInChI=1S/C23H24N2O5/c1-2-28-13-14-30-21-11-4-3-10-20(21)23(27)25-18-8-5-7-17(15-18)22(26)24-16-19-9-6-12-29-19/h3-12,15H,2,13-14,16H2,1H3,(H,24,26)(H,25,27)
InChIKeyVZNWAPCNFGJVLP-UHFFFAOYSA-N
XLogP3.88
TPSA89.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.45
LogP ≤ 53.88
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-ethoxyethoxy)-N-[3-(furan-2-ylmethylcarbamoyl)phenyl]benzamide?
The IUPAC name of 2-(2-ethoxyethoxy)-N-[3-(furan-2-ylmethylcarbamoyl)phenyl]benzamide (CID 17200047) is 2-(2-ethoxyethoxy)-N-[3-(furan-2-ylmethylcarbamoyl)phenyl]benzamide.
What is the SMILES notation for 2-(2-ethoxyethoxy)-N-[3-(furan-2-ylmethylcarbamoyl)phenyl]benzamide?
The canonical SMILES for 2-(2-ethoxyethoxy)-N-[3-(furan-2-ylmethylcarbamoyl)phenyl]benzamide is CCOCCOc1ccccc1C(=O)Nc1cccc(C(=O)NCc2ccco2)c1.
What is the InChIKey of 2-(2-ethoxyethoxy)-N-[3-(furan-2-ylmethylcarbamoyl)phenyl]benzamide?
The InChIKey is VZNWAPCNFGJVLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O5/c1-2-28-13-14-30-21-11-4-3-10-20(21)23(27)25-18-8-5-7-17(15-18)22(26)24-16-19-9-6-12-29-19/h3-12,15H,2,13-14,16H2,1H3,(H,24,26)(H,25,27).
What are the key properties of 2-(2-ethoxyethoxy)-N-[3-(furan-2-ylmethylcarbamoyl)phenyl]benzamide?
2-(2-ethoxyethoxy)-N-[3-(furan-2-ylmethylcarbamoyl)phenyl]benzamide has a molecular weight of 408.45 g/mol, XLogP of 3.88, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxyethoxy)-N-[3-(furan-2-ylmethylcarbamoyl)phenyl]benzamide is sourced from PubChem (CID 17200047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).