2-methoxy-2-methyl-N-(2,2,3,3-tetrafluoropropyl)propanamide

C8H13F4NO2 — CID 103528802

IUPAC2-methoxy-2-methyl-N-(2,2,3,3-tetrafluoropropyl)propanamide
SMILESCOC(C)(C)C(=O)NCC(F)(F)C(F)F
InChIInChI=1S/C8H13F4NO2/c1-7(2,15-3)6(14)13-4-8(11,12)5(9)10/h5H,4H2,1-3H3,(H,13,14)
InChIKeyVKVFEXAOKJPFKK-UHFFFAOYSA-N
MW231.19 g/mol
LogP1.43
Rot. Bonds5

About 2-methoxy-2-methyl-N-(2,2,3,3-tetrafluoropropyl)propanamide

2-methoxy-2-methyl-N-(2,2,3,3-tetrafluoropropyl)propanamide (PubChem CID 103528802) has the molecular formula C8H13F4NO2 and a molecular weight of 231.19 g/mol. Its IUPAC name is 2-methoxy-2-methyl-N-(2,2,3,3-tetrafluoropropyl)propanamide.

Molecular Properties

Compound Name2-methoxy-2-methyl-N-(2,2,3,3-tetrafluoropropyl)propanamide
PubChem CID103528802
Molecular FormulaC8H13F4NO2
Molecular Weight231.19 g/mol
Exact Mass231.09
IUPAC Name2-methoxy-2-methyl-N-(2,2,3,3-tetrafluoropropyl)propanamide
SMILESCOC(C)(C)C(=O)NCC(F)(F)C(F)F
InChIInChI=1S/C8H13F4NO2/c1-7(2,15-3)6(14)13-4-8(11,12)5(9)10/h5H,4H2,1-3H3,(H,13,14)
InChIKeyVKVFEXAOKJPFKK-UHFFFAOYSA-N
XLogP1.43
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.19
LogP ≤ 51.43
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-methoxy-2-methyl-N-(2,2,3,3-tetrafluoropropyl)propanamide?
The IUPAC name of 2-methoxy-2-methyl-N-(2,2,3,3-tetrafluoropropyl)propanamide (CID 103528802) is 2-methoxy-2-methyl-N-(2,2,3,3-tetrafluoropropyl)propanamide.
What is the SMILES notation for 2-methoxy-2-methyl-N-(2,2,3,3-tetrafluoropropyl)propanamide?
The canonical SMILES for 2-methoxy-2-methyl-N-(2,2,3,3-tetrafluoropropyl)propanamide is COC(C)(C)C(=O)NCC(F)(F)C(F)F.
What is the InChIKey of 2-methoxy-2-methyl-N-(2,2,3,3-tetrafluoropropyl)propanamide?
The InChIKey is VKVFEXAOKJPFKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13F4NO2/c1-7(2,15-3)6(14)13-4-8(11,12)5(9)10/h5H,4H2,1-3H3,(H,13,14).
What are the key properties of 2-methoxy-2-methyl-N-(2,2,3,3-tetrafluoropropyl)propanamide?
2-methoxy-2-methyl-N-(2,2,3,3-tetrafluoropropyl)propanamide has a molecular weight of 231.19 g/mol, XLogP of 1.43, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-2-methyl-N-(2,2,3,3-tetrafluoropropyl)propanamide is sourced from PubChem (CID 103528802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).