2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]-N-methyl-N-prop-2-enylpropanamide

C16H8F23NO4 — CID 54025923

IUPAC2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]-N-methyl-N-prop-2-enylpropanamide
SMILESC=CCN(C)C(=O)C(F)(OC(F)(F)C(F)(OC(F)(F)C(F)(OC(F)(F)C(F)(F)C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C16H8F23NO4/c1-3-4-40(2)5(41)6(17,10(22,23)24)42-15(36,37)8(20,12(28,29)30)44-16(38,39)9(21,13(31,32)33)43-14(34,35)7(18,19)11(25,26)27/h3H,1,4H2,2H3
InChIKeyLCDWAASWPXMFTR-UHFFFAOYSA-N
MW715.20 g/mol
LogP7.34
Rot. Bonds12

About 2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]-N-methyl-N-prop-2-enylpropanamide

2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]-N-methyl-N-prop-2-enylpropanamide (PubChem CID 54025923) has the molecular formula C16H8F23NO4 and a molecular weight of 715.20 g/mol. Its IUPAC name is 2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]-N-methyl-N-prop-2-enylpropanamide.

Molecular Properties

Compound Name2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]-N-methyl-N-prop-2-enylpropanamide
PubChem CID54025923
Molecular FormulaC16H8F23NO4
Molecular Weight715.20 g/mol
Exact Mass715.01
IUPAC Name2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]-N-methyl-N-prop-2-enylpropanamide
SMILESC=CCN(C)C(=O)C(F)(OC(F)(F)C(F)(OC(F)(F)C(F)(OC(F)(F)C(F)(F)C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C16H8F23NO4/c1-3-4-40(2)5(41)6(17,10(22,23)24)42-15(36,37)8(20,12(28,29)30)44-16(38,39)9(21,13(31,32)33)43-14(34,35)7(18,19)11(25,26)27/h3H,1,4H2,2H3
InChIKeyLCDWAASWPXMFTR-UHFFFAOYSA-N
XLogP7.34
TPSA48.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500715.20
LogP ≤ 57.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]-N-methyl-N-prop-2-enylpropanamide?
The IUPAC name of 2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]-N-methyl-N-prop-2-enylpropanamide (CID 54025923) is 2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]-N-methyl-N-prop-2-enylpropanamide.
What is the SMILES notation for 2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]-N-methyl-N-prop-2-enylpropanamide?
The canonical SMILES for 2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]-N-methyl-N-prop-2-enylpropanamide is C=CCN(C)C(=O)C(F)(OC(F)(F)C(F)(OC(F)(F)C(F)(OC(F)(F)C(F)(F)C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F.
What is the InChIKey of 2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]-N-methyl-N-prop-2-enylpropanamide?
The InChIKey is LCDWAASWPXMFTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H8F23NO4/c1-3-4-40(2)5(41)6(17,10(22,23)24)42-15(36,37)8(20,12(28,29)30)44-16(38,39)9(21,13(31,32)33)43-14(34,35)7(18,19)11(25,26)27/h3H,1,4H2,2H3.
What are the key properties of 2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]-N-methyl-N-prop-2-enylpropanamide?
2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]-N-methyl-N-prop-2-enylpropanamide has a molecular weight of 715.20 g/mol, XLogP of 7.34, 12 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]-N-methyl-N-prop-2-enylpropanamide is sourced from PubChem (CID 54025923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).