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

C6H11F2NO3 — CID 103513910

IUPAC2,2-difluoro-N-[2-(2-hydroxyethoxy)ethyl]acetamide
SMILESO=C(NCCOCCO)C(F)F
InChIInChI=1S/C6H11F2NO3/c7-5(8)6(11)9-1-3-12-4-2-10/h5,10H,1-4H2,(H,9,11)
InChIKeySYFKRCBZLZFIGJ-UHFFFAOYSA-N
MW183.15 g/mol
LogP-0.62
Rot. Bonds6

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

2,2-difluoro-N-[2-(2-hydroxyethoxy)ethyl]acetamide (PubChem CID 103513910) has the molecular formula C6H11F2NO3 and a molecular weight of 183.15 g/mol. Its IUPAC name is 2,2-difluoro-N-[2-(2-hydroxyethoxy)ethyl]acetamide.

Molecular Properties

Compound Name2,2-difluoro-N-[2-(2-hydroxyethoxy)ethyl]acetamide
PubChem CID103513910
Molecular FormulaC6H11F2NO3
Molecular Weight183.15 g/mol
Exact Mass183.07
IUPAC Name2,2-difluoro-N-[2-(2-hydroxyethoxy)ethyl]acetamide
SMILESO=C(NCCOCCO)C(F)F
InChIInChI=1S/C6H11F2NO3/c7-5(8)6(11)9-1-3-12-4-2-10/h5,10H,1-4H2,(H,9,11)
InChIKeySYFKRCBZLZFIGJ-UHFFFAOYSA-N
XLogP-0.62
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.15
LogP ≤ 5-0.62
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-difluoro-N-[2-(2-hydroxyethoxy)ethyl]acetamide?
The IUPAC name of 2,2-difluoro-N-[2-(2-hydroxyethoxy)ethyl]acetamide (CID 103513910) is 2,2-difluoro-N-[2-(2-hydroxyethoxy)ethyl]acetamide.
What is the SMILES notation for 2,2-difluoro-N-[2-(2-hydroxyethoxy)ethyl]acetamide?
The canonical SMILES for 2,2-difluoro-N-[2-(2-hydroxyethoxy)ethyl]acetamide is O=C(NCCOCCO)C(F)F.
What is the InChIKey of 2,2-difluoro-N-[2-(2-hydroxyethoxy)ethyl]acetamide?
The InChIKey is SYFKRCBZLZFIGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11F2NO3/c7-5(8)6(11)9-1-3-12-4-2-10/h5,10H,1-4H2,(H,9,11).
What are the key properties of 2,2-difluoro-N-[2-(2-hydroxyethoxy)ethyl]acetamide?
2,2-difluoro-N-[2-(2-hydroxyethoxy)ethyl]acetamide has a molecular weight of 183.15 g/mol, XLogP of -0.62, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-N-[2-(2-hydroxyethoxy)ethyl]acetamide is sourced from PubChem (CID 103513910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).