2,2,3,3,4,4,5,5,6,6-decafluoro-1-(1,1,2,2-tetrafluoropropyl)piperidine

C8H3F14N — CID 129156369

IUPAC2,2,3,3,4,4,5,5,6,6-decafluoro-1-(1,1,2,2-tetrafluoropropyl)piperidine
SMILESCC(F)(F)C(F)(F)N1C(F)(F)C(F)(F)C(F)(F)C(F)(F)C1(F)F
InChIInChI=1S/C8H3F14N/c1-2(9,10)6(17,18)23-7(19,20)4(13,14)3(11,12)5(15,16)8(23,21)22/h1H3
InChIKeyVBKMQXIJZNJYDM-UHFFFAOYSA-N
MW379.09 g/mol
LogP4.64
Rot. Bonds2

About 2,2,3,3,4,4,5,5,6,6-decafluoro-1-(1,1,2,2-tetrafluoropropyl)piperidine

2,2,3,3,4,4,5,5,6,6-decafluoro-1-(1,1,2,2-tetrafluoropropyl)piperidine (PubChem CID 129156369) has the molecular formula C8H3F14N and a molecular weight of 379.09 g/mol. Its IUPAC name is 2,2,3,3,4,4,5,5,6,6-decafluoro-1-(1,1,2,2-tetrafluoropropyl)piperidine.

Molecular Properties

Compound Name2,2,3,3,4,4,5,5,6,6-decafluoro-1-(1,1,2,2-tetrafluoropropyl)piperidine
PubChem CID129156369
Molecular FormulaC8H3F14N
Molecular Weight379.09 g/mol
Exact Mass379.00
IUPAC Name2,2,3,3,4,4,5,5,6,6-decafluoro-1-(1,1,2,2-tetrafluoropropyl)piperidine
SMILESCC(F)(F)C(F)(F)N1C(F)(F)C(F)(F)C(F)(F)C(F)(F)C1(F)F
InChIInChI=1S/C8H3F14N/c1-2(9,10)6(17,18)23-7(19,20)4(13,14)3(11,12)5(15,16)8(23,21)22/h1H3
InChIKeyVBKMQXIJZNJYDM-UHFFFAOYSA-N
XLogP4.64
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.09
LogP ≤ 54.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,2,3,3,4,4,5,5,6,6-decafluoro-1-(1,1,2,2-tetrafluoropropyl)piperidine?
The IUPAC name of 2,2,3,3,4,4,5,5,6,6-decafluoro-1-(1,1,2,2-tetrafluoropropyl)piperidine (CID 129156369) is 2,2,3,3,4,4,5,5,6,6-decafluoro-1-(1,1,2,2-tetrafluoropropyl)piperidine.
What is the SMILES notation for 2,2,3,3,4,4,5,5,6,6-decafluoro-1-(1,1,2,2-tetrafluoropropyl)piperidine?
The canonical SMILES for 2,2,3,3,4,4,5,5,6,6-decafluoro-1-(1,1,2,2-tetrafluoropropyl)piperidine is CC(F)(F)C(F)(F)N1C(F)(F)C(F)(F)C(F)(F)C(F)(F)C1(F)F.
What is the InChIKey of 2,2,3,3,4,4,5,5,6,6-decafluoro-1-(1,1,2,2-tetrafluoropropyl)piperidine?
The InChIKey is VBKMQXIJZNJYDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H3F14N/c1-2(9,10)6(17,18)23-7(19,20)4(13,14)3(11,12)5(15,16)8(23,21)22/h1H3.
What are the key properties of 2,2,3,3,4,4,5,5,6,6-decafluoro-1-(1,1,2,2-tetrafluoropropyl)piperidine?
2,2,3,3,4,4,5,5,6,6-decafluoro-1-(1,1,2,2-tetrafluoropropyl)piperidine has a molecular weight of 379.09 g/mol, XLogP of 4.64, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,3,4,4,5,5,6,6-decafluoro-1-(1,1,2,2-tetrafluoropropyl)piperidine is sourced from PubChem (CID 129156369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).