1-[(Z)-1,3,3,3-tetrafluoroprop-1-enyl]piperidine

C8H11F4N — CID 11964063

IUPAC1-[(Z)-1,3,3,3-tetrafluoroprop-1-enyl]piperidine
SMILESF/C(=C\C(F)(F)F)N1CCCCC1
InChIInChI=1S/C8H11F4N/c9-7(6-8(10,11)12)13-4-2-1-3-5-13/h6H,1-5H2/b7-6+
InChIKeyABVDSBHEEVPLIS-VOTSOKGWSA-N
MW197.17 g/mol
LogP2.85
Rot. Bonds1

About 1-[(Z)-1,3,3,3-tetrafluoroprop-1-enyl]piperidine

1-[(Z)-1,3,3,3-tetrafluoroprop-1-enyl]piperidine (PubChem CID 11964063) has the molecular formula C8H11F4N and a molecular weight of 197.17 g/mol. Its IUPAC name is 1-[(Z)-1,3,3,3-tetrafluoroprop-1-enyl]piperidine.

Molecular Properties

Compound Name1-[(Z)-1,3,3,3-tetrafluoroprop-1-enyl]piperidine
PubChem CID11964063
Molecular FormulaC8H11F4N
Molecular Weight197.17 g/mol
Exact Mass197.08
IUPAC Name1-[(Z)-1,3,3,3-tetrafluoroprop-1-enyl]piperidine
SMILESF/C(=C\C(F)(F)F)N1CCCCC1
InChIInChI=1S/C8H11F4N/c9-7(6-8(10,11)12)13-4-2-1-3-5-13/h6H,1-5H2/b7-6+
InChIKeyABVDSBHEEVPLIS-VOTSOKGWSA-N
XLogP2.85
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.17
LogP ≤ 52.85
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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Frequently Asked Questions

What is the IUPAC name of 1-[(Z)-1,3,3,3-tetrafluoroprop-1-enyl]piperidine?
The IUPAC name of 1-[(Z)-1,3,3,3-tetrafluoroprop-1-enyl]piperidine (CID 11964063) is 1-[(Z)-1,3,3,3-tetrafluoroprop-1-enyl]piperidine.
What is the SMILES notation for 1-[(Z)-1,3,3,3-tetrafluoroprop-1-enyl]piperidine?
The canonical SMILES for 1-[(Z)-1,3,3,3-tetrafluoroprop-1-enyl]piperidine is F/C(=C\C(F)(F)F)N1CCCCC1.
What is the InChIKey of 1-[(Z)-1,3,3,3-tetrafluoroprop-1-enyl]piperidine?
The InChIKey is ABVDSBHEEVPLIS-VOTSOKGWSA-N. The full InChI is InChI=1S/C8H11F4N/c9-7(6-8(10,11)12)13-4-2-1-3-5-13/h6H,1-5H2/b7-6+.
What are the key properties of 1-[(Z)-1,3,3,3-tetrafluoroprop-1-enyl]piperidine?
1-[(Z)-1,3,3,3-tetrafluoroprop-1-enyl]piperidine has a molecular weight of 197.17 g/mol, XLogP of 2.85, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(Z)-1,3,3,3-tetrafluoroprop-1-enyl]piperidine is sourced from PubChem (CID 11964063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).