2-(2-ethenyl-2-fluorocyclopentyl)piperidine

C12H20FN — CID 131137790

IUPAC2-(2-ethenyl-2-fluorocyclopentyl)piperidine
SMILESC=CC1(F)CCCC1C1CCCCN1
InChIInChI=1S/C12H20FN/c1-2-12(13)8-5-6-10(12)11-7-3-4-9-14-11/h2,10-11,14H,1,3-9H2
InChIKeyCNBOPCLSHJTEIY-UHFFFAOYSA-N
MW197.30 g/mol
LogP2.82
Rot. Bonds2

About 2-(2-ethenyl-2-fluorocyclopentyl)piperidine

2-(2-ethenyl-2-fluorocyclopentyl)piperidine (PubChem CID 131137790) has the molecular formula C12H20FN and a molecular weight of 197.30 g/mol. Its IUPAC name is 2-(2-ethenyl-2-fluorocyclopentyl)piperidine.

Molecular Properties

Compound Name2-(2-ethenyl-2-fluorocyclopentyl)piperidine
PubChem CID131137790
Molecular FormulaC12H20FN
Molecular Weight197.30 g/mol
Exact Mass197.16
IUPAC Name2-(2-ethenyl-2-fluorocyclopentyl)piperidine
SMILESC=CC1(F)CCCC1C1CCCCN1
InChIInChI=1S/C12H20FN/c1-2-12(13)8-5-6-10(12)11-7-3-4-9-14-11/h2,10-11,14H,1,3-9H2
InChIKeyCNBOPCLSHJTEIY-UHFFFAOYSA-N
XLogP2.82
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.30
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2-ethenyl-2-fluorocyclopentyl)piperidine?
The IUPAC name of 2-(2-ethenyl-2-fluorocyclopentyl)piperidine (CID 131137790) is 2-(2-ethenyl-2-fluorocyclopentyl)piperidine.
What is the SMILES notation for 2-(2-ethenyl-2-fluorocyclopentyl)piperidine?
The canonical SMILES for 2-(2-ethenyl-2-fluorocyclopentyl)piperidine is C=CC1(F)CCCC1C1CCCCN1.
What is the InChIKey of 2-(2-ethenyl-2-fluorocyclopentyl)piperidine?
The InChIKey is CNBOPCLSHJTEIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20FN/c1-2-12(13)8-5-6-10(12)11-7-3-4-9-14-11/h2,10-11,14H,1,3-9H2.
What are the key properties of 2-(2-ethenyl-2-fluorocyclopentyl)piperidine?
2-(2-ethenyl-2-fluorocyclopentyl)piperidine has a molecular weight of 197.30 g/mol, XLogP of 2.82, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethenyl-2-fluorocyclopentyl)piperidine is sourced from PubChem (CID 131137790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).