3-fluoro-N-[2-(2-propoxyethoxy)ethyl]propanamide

C10H20FNO3 — CID 135199615

IUPAC3-fluoro-N-[2-(2-propoxyethoxy)ethyl]propanamide
SMILESCCCOCCOCCNC(=O)CCF
InChIInChI=1S/C10H20FNO3/c1-2-6-14-8-9-15-7-5-12-10(13)3-4-11/h2-9H2,1H3,(H,12,13)
InChIKeyFPAKPTVUWPDARJ-UHFFFAOYSA-N
MW221.27 g/mol
LogP0.91
Rot. Bonds10

About 3-fluoro-N-[2-(2-propoxyethoxy)ethyl]propanamide

3-fluoro-N-[2-(2-propoxyethoxy)ethyl]propanamide (PubChem CID 135199615) has the molecular formula C10H20FNO3 and a molecular weight of 221.27 g/mol. Its IUPAC name is 3-fluoro-N-[2-(2-propoxyethoxy)ethyl]propanamide.

Molecular Properties

Compound Name3-fluoro-N-[2-(2-propoxyethoxy)ethyl]propanamide
PubChem CID135199615
Molecular FormulaC10H20FNO3
Molecular Weight221.27 g/mol
Exact Mass221.14
IUPAC Name3-fluoro-N-[2-(2-propoxyethoxy)ethyl]propanamide
SMILESCCCOCCOCCNC(=O)CCF
InChIInChI=1S/C10H20FNO3/c1-2-6-14-8-9-15-7-5-12-10(13)3-4-11/h2-9H2,1H3,(H,12,13)
InChIKeyFPAKPTVUWPDARJ-UHFFFAOYSA-N
XLogP0.91
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.27
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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 3-fluoro-N-[2-(2-propoxyethoxy)ethyl]propanamide?
The IUPAC name of 3-fluoro-N-[2-(2-propoxyethoxy)ethyl]propanamide (CID 135199615) is 3-fluoro-N-[2-(2-propoxyethoxy)ethyl]propanamide.
What is the SMILES notation for 3-fluoro-N-[2-(2-propoxyethoxy)ethyl]propanamide?
The canonical SMILES for 3-fluoro-N-[2-(2-propoxyethoxy)ethyl]propanamide is CCCOCCOCCNC(=O)CCF.
What is the InChIKey of 3-fluoro-N-[2-(2-propoxyethoxy)ethyl]propanamide?
The InChIKey is FPAKPTVUWPDARJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20FNO3/c1-2-6-14-8-9-15-7-5-12-10(13)3-4-11/h2-9H2,1H3,(H,12,13).
What are the key properties of 3-fluoro-N-[2-(2-propoxyethoxy)ethyl]propanamide?
3-fluoro-N-[2-(2-propoxyethoxy)ethyl]propanamide has a molecular weight of 221.27 g/mol, XLogP of 0.91, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-[2-(2-propoxyethoxy)ethyl]propanamide is sourced from PubChem (CID 135199615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).