2-[[2-(4-ethoxyphenoxy)acetyl]amino]-N-(furan-2-ylmethyl)acetamide

C17H20N2O5 — CID 9079933

IUPAC2-[[2-(4-ethoxyphenoxy)acetyl]amino]-N-(furan-2-ylmethyl)acetamide
SMILESCCOc1ccc(OCC(=O)NCC(=O)NCc2ccco2)cc1
InChIInChI=1S/C17H20N2O5/c1-2-22-13-5-7-14(8-6-13)24-12-17(21)19-11-16(20)18-10-15-4-3-9-23-15/h3-9H,2,10-12H2,1H3,(H,18,20)(H,19,21)
InChIKeyGGTUTOBLNHAOCR-UHFFFAOYSA-N
MW332.36 g/mol
LogP1.49
Rot. Bonds9

About 2-[[2-(4-ethoxyphenoxy)acetyl]amino]-N-(furan-2-ylmethyl)acetamide

2-[[2-(4-ethoxyphenoxy)acetyl]amino]-N-(furan-2-ylmethyl)acetamide (PubChem CID 9079933) has the molecular formula C17H20N2O5 and a molecular weight of 332.36 g/mol. Its IUPAC name is 2-[[2-(4-ethoxyphenoxy)acetyl]amino]-N-(furan-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-[[2-(4-ethoxyphenoxy)acetyl]amino]-N-(furan-2-ylmethyl)acetamide
PubChem CID9079933
Molecular FormulaC17H20N2O5
Molecular Weight332.36 g/mol
Exact Mass332.14
IUPAC Name2-[[2-(4-ethoxyphenoxy)acetyl]amino]-N-(furan-2-ylmethyl)acetamide
SMILESCCOc1ccc(OCC(=O)NCC(=O)NCc2ccco2)cc1
InChIInChI=1S/C17H20N2O5/c1-2-22-13-5-7-14(8-6-13)24-12-17(21)19-11-16(20)18-10-15-4-3-9-23-15/h3-9H,2,10-12H2,1H3,(H,18,20)(H,19,21)
InChIKeyGGTUTOBLNHAOCR-UHFFFAOYSA-N
XLogP1.49
TPSA89.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.36
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[[2-(4-ethoxyphenoxy)acetyl]amino]-N-(furan-2-ylmethyl)acetamide?
The IUPAC name of 2-[[2-(4-ethoxyphenoxy)acetyl]amino]-N-(furan-2-ylmethyl)acetamide (CID 9079933) is 2-[[2-(4-ethoxyphenoxy)acetyl]amino]-N-(furan-2-ylmethyl)acetamide.
What is the SMILES notation for 2-[[2-(4-ethoxyphenoxy)acetyl]amino]-N-(furan-2-ylmethyl)acetamide?
The canonical SMILES for 2-[[2-(4-ethoxyphenoxy)acetyl]amino]-N-(furan-2-ylmethyl)acetamide is CCOc1ccc(OCC(=O)NCC(=O)NCc2ccco2)cc1.
What is the InChIKey of 2-[[2-(4-ethoxyphenoxy)acetyl]amino]-N-(furan-2-ylmethyl)acetamide?
The InChIKey is GGTUTOBLNHAOCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O5/c1-2-22-13-5-7-14(8-6-13)24-12-17(21)19-11-16(20)18-10-15-4-3-9-23-15/h3-9H,2,10-12H2,1H3,(H,18,20)(H,19,21).
What are the key properties of 2-[[2-(4-ethoxyphenoxy)acetyl]amino]-N-(furan-2-ylmethyl)acetamide?
2-[[2-(4-ethoxyphenoxy)acetyl]amino]-N-(furan-2-ylmethyl)acetamide has a molecular weight of 332.36 g/mol, XLogP of 1.49, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(4-ethoxyphenoxy)acetyl]amino]-N-(furan-2-ylmethyl)acetamide is sourced from PubChem (CID 9079933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).