2,2,2-trifluoro-N-[2-(2-hydroxyethoxy)ethyl]acetamide

C6H10F3NO3 — CID 56637024

IUPAC2,2,2-trifluoro-N-[2-(2-hydroxyethoxy)ethyl]acetamide
SMILESO=C(NCCOCCO)C(F)(F)F
InChIInChI=1S/C6H10F3NO3/c7-6(8,9)5(12)10-1-3-13-4-2-11/h11H,1-4H2,(H,10,12)
InChIKeyRNRCOGKAZKSKNB-UHFFFAOYSA-N
MW201.14 g/mol
LogP-0.33
Rot. Bonds5

About 2,2,2-trifluoro-N-[2-(2-hydroxyethoxy)ethyl]acetamide

2,2,2-trifluoro-N-[2-(2-hydroxyethoxy)ethyl]acetamide (PubChem CID 56637024) has the molecular formula C6H10F3NO3 and a molecular weight of 201.14 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-[2-(2-hydroxyethoxy)ethyl]acetamide.

Molecular Properties

Compound Name2,2,2-trifluoro-N-[2-(2-hydroxyethoxy)ethyl]acetamide
PubChem CID56637024
Molecular FormulaC6H10F3NO3
Molecular Weight201.14 g/mol
Exact Mass201.06
IUPAC Name2,2,2-trifluoro-N-[2-(2-hydroxyethoxy)ethyl]acetamide
SMILESO=C(NCCOCCO)C(F)(F)F
InChIInChI=1S/C6H10F3NO3/c7-6(8,9)5(12)10-1-3-13-4-2-11/h11H,1-4H2,(H,10,12)
InChIKeyRNRCOGKAZKSKNB-UHFFFAOYSA-N
XLogP-0.33
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.14
LogP ≤ 5-0.33
H-Bond Donors ≤ 52
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 2,2,2-trifluoro-N-[2-(2-hydroxyethoxy)ethyl]acetamide?
The IUPAC name of 2,2,2-trifluoro-N-[2-(2-hydroxyethoxy)ethyl]acetamide (CID 56637024) is 2,2,2-trifluoro-N-[2-(2-hydroxyethoxy)ethyl]acetamide.
What is the SMILES notation for 2,2,2-trifluoro-N-[2-(2-hydroxyethoxy)ethyl]acetamide?
The canonical SMILES for 2,2,2-trifluoro-N-[2-(2-hydroxyethoxy)ethyl]acetamide is O=C(NCCOCCO)C(F)(F)F.
What is the InChIKey of 2,2,2-trifluoro-N-[2-(2-hydroxyethoxy)ethyl]acetamide?
The InChIKey is RNRCOGKAZKSKNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F3NO3/c7-6(8,9)5(12)10-1-3-13-4-2-11/h11H,1-4H2,(H,10,12).
What are the key properties of 2,2,2-trifluoro-N-[2-(2-hydroxyethoxy)ethyl]acetamide?
2,2,2-trifluoro-N-[2-(2-hydroxyethoxy)ethyl]acetamide has a molecular weight of 201.14 g/mol, XLogP of -0.33, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-[2-(2-hydroxyethoxy)ethyl]acetamide is sourced from PubChem (CID 56637024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).