1-[1,1,3,3-tetrafluoro-2-(trifluoromethyl)prop-2-enyl]pyrrolidine

C8H8F7N — CID 129271752

IUPAC1-[1,1,3,3-tetrafluoro-2-(trifluoromethyl)prop-2-enyl]pyrrolidine
SMILESFC(F)=C(C(F)(F)F)C(F)(F)N1CCCC1
InChIInChI=1S/C8H8F7N/c9-6(10)5(7(11,12)13)8(14,15)16-3-1-2-4-16/h1-4H2
InChIKeyFWYVGJZZNFZWGB-UHFFFAOYSA-N
MW251.14 g/mol
LogP3.39
Rot. Bonds2

About 1-[1,1,3,3-tetrafluoro-2-(trifluoromethyl)prop-2-enyl]pyrrolidine

1-[1,1,3,3-tetrafluoro-2-(trifluoromethyl)prop-2-enyl]pyrrolidine (PubChem CID 129271752) has the molecular formula C8H8F7N and a molecular weight of 251.14 g/mol. Its IUPAC name is 1-[1,1,3,3-tetrafluoro-2-(trifluoromethyl)prop-2-enyl]pyrrolidine.

Molecular Properties

Compound Name1-[1,1,3,3-tetrafluoro-2-(trifluoromethyl)prop-2-enyl]pyrrolidine
PubChem CID129271752
Molecular FormulaC8H8F7N
Molecular Weight251.14 g/mol
Exact Mass251.05
IUPAC Name1-[1,1,3,3-tetrafluoro-2-(trifluoromethyl)prop-2-enyl]pyrrolidine
SMILESFC(F)=C(C(F)(F)F)C(F)(F)N1CCCC1
InChIInChI=1S/C8H8F7N/c9-6(10)5(7(11,12)13)8(14,15)16-3-1-2-4-16/h1-4H2
InChIKeyFWYVGJZZNFZWGB-UHFFFAOYSA-N
XLogP3.39
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.14
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Related Compounds

1-Diethylaminoheptafluoroisobutylene
CID 129807003
1-[(E)-1,2,3,3,3-pentafluoroprop-1-enyl]pyrrolidine
CID 13864934
1-(1,1,2-Trifluoroprop-2-enyl)pyrrolidine
CID 129207502
1-[1,1-Difluoro-2-(trifluoromethyl)prop-2-enyl]pyrrolidine
CID 129207505
1-[1-Fluoro-2-(trifluoromethyl)prop-2-enyl]pyrrolidine
CID 129207795
1-(1,1,2,3,3-Pentafluoroprop-2-enyl)pyrrolidine
CID 129271429
1-(1,1,1,2,3,4,4-Heptafluorobut-3-en-2-yl)pyrrolidine
CID 129271748
1-(1,3,3,3-Tetrafluoro-2-methylprop-1-enyl)pyrrolidine
CID 130227408
1-[1,3,3-Trifluoro-2-(trifluoromethyl)prop-2-enyl]pyrrolidine
CID 140940164
Fluoromethane;1-(1,1,3,3-tetrafluoroprop-2-enyl)pyrrolidine
CID 145335478
1-(1,1,2,3,3-Pentafluoroprop-2-enyl)pyrrolidine;hydrofluoride
CID 159100780
1-[1,1,1,4,4,4-Hexafluoro-3-(trifluoromethyl)but-2-en-2-yl]pyrrolidine
CID 166661052

Frequently Asked Questions

What is the IUPAC name of 1-[1,1,3,3-tetrafluoro-2-(trifluoromethyl)prop-2-enyl]pyrrolidine?
The IUPAC name of 1-[1,1,3,3-tetrafluoro-2-(trifluoromethyl)prop-2-enyl]pyrrolidine (CID 129271752) is 1-[1,1,3,3-tetrafluoro-2-(trifluoromethyl)prop-2-enyl]pyrrolidine.
What is the SMILES notation for 1-[1,1,3,3-tetrafluoro-2-(trifluoromethyl)prop-2-enyl]pyrrolidine?
The canonical SMILES for 1-[1,1,3,3-tetrafluoro-2-(trifluoromethyl)prop-2-enyl]pyrrolidine is FC(F)=C(C(F)(F)F)C(F)(F)N1CCCC1.
What is the InChIKey of 1-[1,1,3,3-tetrafluoro-2-(trifluoromethyl)prop-2-enyl]pyrrolidine?
The InChIKey is FWYVGJZZNFZWGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F7N/c9-6(10)5(7(11,12)13)8(14,15)16-3-1-2-4-16/h1-4H2.
What are the key properties of 1-[1,1,3,3-tetrafluoro-2-(trifluoromethyl)prop-2-enyl]pyrrolidine?
1-[1,1,3,3-tetrafluoro-2-(trifluoromethyl)prop-2-enyl]pyrrolidine has a molecular weight of 251.14 g/mol, XLogP of 3.39, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1,1,3,3-tetrafluoro-2-(trifluoromethyl)prop-2-enyl]pyrrolidine is sourced from PubChem (CID 129271752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).