1-(2,2,3,3-tetrafluoropropyl)piperazine

C7H12F4N2 — CID 19622796

IUPAC1-(2,2,3,3-tetrafluoropropyl)piperazine
SMILESFC(F)C(F)(F)CN1CCNCC1
InChIInChI=1S/C7H12F4N2/c8-6(9)7(10,11)5-13-3-1-12-2-4-13/h6,12H,1-5H2
InChIKeyJPLYMOHYRZUZST-UHFFFAOYSA-N
MW200.18 g/mol
LogP0.79
Rot. Bonds3

About 1-(2,2,3,3-tetrafluoropropyl)piperazine

1-(2,2,3,3-tetrafluoropropyl)piperazine (PubChem CID 19622796) has the molecular formula C7H12F4N2 and a molecular weight of 200.18 g/mol. Its IUPAC name is 1-(2,2,3,3-tetrafluoropropyl)piperazine.

Molecular Properties

Compound Name1-(2,2,3,3-tetrafluoropropyl)piperazine
PubChem CID19622796
Molecular FormulaC7H12F4N2
Molecular Weight200.18 g/mol
Exact Mass200.09
IUPAC Name1-(2,2,3,3-tetrafluoropropyl)piperazine
SMILESFC(F)C(F)(F)CN1CCNCC1
InChIInChI=1S/C7H12F4N2/c8-6(9)7(10,11)5-13-3-1-12-2-4-13/h6,12H,1-5H2
InChIKeyJPLYMOHYRZUZST-UHFFFAOYSA-N
XLogP0.79
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.18
LogP ≤ 50.79
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 1-(2,2,3,3-tetrafluoropropyl)piperazine?
The IUPAC name of 1-(2,2,3,3-tetrafluoropropyl)piperazine (CID 19622796) is 1-(2,2,3,3-tetrafluoropropyl)piperazine.
What is the SMILES notation for 1-(2,2,3,3-tetrafluoropropyl)piperazine?
The canonical SMILES for 1-(2,2,3,3-tetrafluoropropyl)piperazine is FC(F)C(F)(F)CN1CCNCC1.
What is the InChIKey of 1-(2,2,3,3-tetrafluoropropyl)piperazine?
The InChIKey is JPLYMOHYRZUZST-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12F4N2/c8-6(9)7(10,11)5-13-3-1-12-2-4-13/h6,12H,1-5H2.
What are the key properties of 1-(2,2,3,3-tetrafluoropropyl)piperazine?
1-(2,2,3,3-tetrafluoropropyl)piperazine has a molecular weight of 200.18 g/mol, XLogP of 0.79, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2,3,3-tetrafluoropropyl)piperazine is sourced from PubChem (CID 19622796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).