2-ethoxy-N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]acetamide

C11H17NO4 — CID 99876293

IUPAC2-ethoxy-N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]acetamide
SMILESCCOCC(=O)NC[C@H](OC)c1ccco1
InChIInChI=1S/C11H17NO4/c1-3-15-8-11(13)12-7-10(14-2)9-5-4-6-16-9/h4-6,10H,3,7-8H2,1-2H3,(H,12,13)/t10-/m0/s1
InChIKeyYBVBBANIZAFJLR-JTQLQIEISA-N
MW227.26 g/mol
LogP1.12
Rot. Bonds7

About 2-ethoxy-N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]acetamide

2-ethoxy-N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]acetamide (PubChem CID 99876293) has the molecular formula C11H17NO4 and a molecular weight of 227.26 g/mol. Its IUPAC name is 2-ethoxy-N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]acetamide.

Molecular Properties

Compound Name2-ethoxy-N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]acetamide
PubChem CID99876293
Molecular FormulaC11H17NO4
Molecular Weight227.26 g/mol
Exact Mass227.12
IUPAC Name2-ethoxy-N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]acetamide
SMILESCCOCC(=O)NC[C@H](OC)c1ccco1
InChIInChI=1S/C11H17NO4/c1-3-15-8-11(13)12-7-10(14-2)9-5-4-6-16-9/h4-6,10H,3,7-8H2,1-2H3,(H,12,13)/t10-/m0/s1
InChIKeyYBVBBANIZAFJLR-JTQLQIEISA-N
XLogP1.12
TPSA60.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.26
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]acetamide?
The IUPAC name of 2-ethoxy-N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]acetamide (CID 99876293) is 2-ethoxy-N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]acetamide.
What is the SMILES notation for 2-ethoxy-N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]acetamide?
The canonical SMILES for 2-ethoxy-N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]acetamide is CCOCC(=O)NC[C@H](OC)c1ccco1.
What is the InChIKey of 2-ethoxy-N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]acetamide?
The InChIKey is YBVBBANIZAFJLR-JTQLQIEISA-N. The full InChI is InChI=1S/C11H17NO4/c1-3-15-8-11(13)12-7-10(14-2)9-5-4-6-16-9/h4-6,10H,3,7-8H2,1-2H3,(H,12,13)/t10-/m0/s1.
What are the key properties of 2-ethoxy-N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]acetamide?
2-ethoxy-N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]acetamide has a molecular weight of 227.26 g/mol, XLogP of 1.12, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]acetamide is sourced from PubChem (CID 99876293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).