2,2,3,3-tetrafluoro-N-(2-hydroxyethyl)-N-methylpropanamide

C6H9F4NO2 — CID 103858633

IUPAC2,2,3,3-tetrafluoro-N-(2-hydroxyethyl)-N-methylpropanamide
SMILESCN(CCO)C(=O)C(F)(F)C(F)F
InChIInChI=1S/C6H9F4NO2/c1-11(2-3-12)5(13)6(9,10)4(7)8/h4,12H,2-3H2,1H3
InChIKeyGZFQUDAAGXFOEM-UHFFFAOYSA-N
MW203.13 g/mol
LogP0.34
Rot. Bonds4

About 2,2,3,3-tetrafluoro-N-(2-hydroxyethyl)-N-methylpropanamide

2,2,3,3-tetrafluoro-N-(2-hydroxyethyl)-N-methylpropanamide (PubChem CID 103858633) has the molecular formula C6H9F4NO2 and a molecular weight of 203.13 g/mol. Its IUPAC name is 2,2,3,3-tetrafluoro-N-(2-hydroxyethyl)-N-methylpropanamide.

Molecular Properties

Compound Name2,2,3,3-tetrafluoro-N-(2-hydroxyethyl)-N-methylpropanamide
PubChem CID103858633
Molecular FormulaC6H9F4NO2
Molecular Weight203.13 g/mol
Exact Mass203.06
IUPAC Name2,2,3,3-tetrafluoro-N-(2-hydroxyethyl)-N-methylpropanamide
SMILESCN(CCO)C(=O)C(F)(F)C(F)F
InChIInChI=1S/C6H9F4NO2/c1-11(2-3-12)5(13)6(9,10)4(7)8/h4,12H,2-3H2,1H3
InChIKeyGZFQUDAAGXFOEM-UHFFFAOYSA-N
XLogP0.34
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.13
LogP ≤ 50.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2,2,3,3-tetrafluoro-N-(2-hydroxyethyl)-N-methylpropanamide?
The IUPAC name of 2,2,3,3-tetrafluoro-N-(2-hydroxyethyl)-N-methylpropanamide (CID 103858633) is 2,2,3,3-tetrafluoro-N-(2-hydroxyethyl)-N-methylpropanamide.
What is the SMILES notation for 2,2,3,3-tetrafluoro-N-(2-hydroxyethyl)-N-methylpropanamide?
The canonical SMILES for 2,2,3,3-tetrafluoro-N-(2-hydroxyethyl)-N-methylpropanamide is CN(CCO)C(=O)C(F)(F)C(F)F.
What is the InChIKey of 2,2,3,3-tetrafluoro-N-(2-hydroxyethyl)-N-methylpropanamide?
The InChIKey is GZFQUDAAGXFOEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9F4NO2/c1-11(2-3-12)5(13)6(9,10)4(7)8/h4,12H,2-3H2,1H3.
What are the key properties of 2,2,3,3-tetrafluoro-N-(2-hydroxyethyl)-N-methylpropanamide?
2,2,3,3-tetrafluoro-N-(2-hydroxyethyl)-N-methylpropanamide has a molecular weight of 203.13 g/mol, XLogP of 0.34, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,3-tetrafluoro-N-(2-hydroxyethyl)-N-methylpropanamide is sourced from PubChem (CID 103858633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).