2,2,3,3-tetrafluoro-N-(2-hydroxy-2-methylpropyl)-N-methylpropanamide

C8H13F4NO2 — CID 103755692

IUPAC2,2,3,3-tetrafluoro-N-(2-hydroxy-2-methylpropyl)-N-methylpropanamide
SMILESCN(CC(C)(C)O)C(=O)C(F)(F)C(F)F
InChIInChI=1S/C8H13F4NO2/c1-7(2,15)4-13(3)6(14)8(11,12)5(9)10/h5,15H,4H2,1-3H3
InChIKeyCGZDGGACECRKEG-UHFFFAOYSA-N
MW231.19 g/mol
LogP1.12
Rot. Bonds4

About 2,2,3,3-tetrafluoro-N-(2-hydroxy-2-methylpropyl)-N-methylpropanamide

2,2,3,3-tetrafluoro-N-(2-hydroxy-2-methylpropyl)-N-methylpropanamide (PubChem CID 103755692) has the molecular formula C8H13F4NO2 and a molecular weight of 231.19 g/mol. Its IUPAC name is 2,2,3,3-tetrafluoro-N-(2-hydroxy-2-methylpropyl)-N-methylpropanamide.

Molecular Properties

Compound Name2,2,3,3-tetrafluoro-N-(2-hydroxy-2-methylpropyl)-N-methylpropanamide
PubChem CID103755692
Molecular FormulaC8H13F4NO2
Molecular Weight231.19 g/mol
Exact Mass231.09
IUPAC Name2,2,3,3-tetrafluoro-N-(2-hydroxy-2-methylpropyl)-N-methylpropanamide
SMILESCN(CC(C)(C)O)C(=O)C(F)(F)C(F)F
InChIInChI=1S/C8H13F4NO2/c1-7(2,15)4-13(3)6(14)8(11,12)5(9)10/h5,15H,4H2,1-3H3
InChIKeyCGZDGGACECRKEG-UHFFFAOYSA-N
XLogP1.12
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.19
LogP ≤ 51.12
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-hydroxy-2-methylpropyl)-N-methylpropanamide?
The IUPAC name of 2,2,3,3-tetrafluoro-N-(2-hydroxy-2-methylpropyl)-N-methylpropanamide (CID 103755692) is 2,2,3,3-tetrafluoro-N-(2-hydroxy-2-methylpropyl)-N-methylpropanamide.
What is the SMILES notation for 2,2,3,3-tetrafluoro-N-(2-hydroxy-2-methylpropyl)-N-methylpropanamide?
The canonical SMILES for 2,2,3,3-tetrafluoro-N-(2-hydroxy-2-methylpropyl)-N-methylpropanamide is CN(CC(C)(C)O)C(=O)C(F)(F)C(F)F.
What is the InChIKey of 2,2,3,3-tetrafluoro-N-(2-hydroxy-2-methylpropyl)-N-methylpropanamide?
The InChIKey is CGZDGGACECRKEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13F4NO2/c1-7(2,15)4-13(3)6(14)8(11,12)5(9)10/h5,15H,4H2,1-3H3.
What are the key properties of 2,2,3,3-tetrafluoro-N-(2-hydroxy-2-methylpropyl)-N-methylpropanamide?
2,2,3,3-tetrafluoro-N-(2-hydroxy-2-methylpropyl)-N-methylpropanamide has a molecular weight of 231.19 g/mol, XLogP of 1.12, 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-hydroxy-2-methylpropyl)-N-methylpropanamide is sourced from PubChem (CID 103755692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).