2-ethyl-3-fluoro-5-methylidenepiperidine

C8H14FN — CID 91363371

IUPAC2-ethyl-3-fluoro-5-methylidenepiperidine
SMILESC=C1CNC(CC)C(F)C1
InChIInChI=1S/C8H14FN/c1-3-8-7(9)4-6(2)5-10-8/h7-8,10H,2-5H2,1H3
InChIKeyVGINOTYBNZLIAO-UHFFFAOYSA-N
MW143.20 g/mol
LogP1.65
Rot. Bonds1

About 2-ethyl-3-fluoro-5-methylidenepiperidine

2-ethyl-3-fluoro-5-methylidenepiperidine (PubChem CID 91363371) has the molecular formula C8H14FN and a molecular weight of 143.20 g/mol. Its IUPAC name is 2-ethyl-3-fluoro-5-methylidenepiperidine.

Molecular Properties

Compound Name2-ethyl-3-fluoro-5-methylidenepiperidine
PubChem CID91363371
Molecular FormulaC8H14FN
Molecular Weight143.20 g/mol
Exact Mass143.11
IUPAC Name2-ethyl-3-fluoro-5-methylidenepiperidine
SMILESC=C1CNC(CC)C(F)C1
InChIInChI=1S/C8H14FN/c1-3-8-7(9)4-6(2)5-10-8/h7-8,10H,2-5H2,1H3
InChIKeyVGINOTYBNZLIAO-UHFFFAOYSA-N
XLogP1.65
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.20
LogP ≤ 51.65
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-ethyl-3-fluoro-5-methylidenepiperidine?
The IUPAC name of 2-ethyl-3-fluoro-5-methylidenepiperidine (CID 91363371) is 2-ethyl-3-fluoro-5-methylidenepiperidine.
What is the SMILES notation for 2-ethyl-3-fluoro-5-methylidenepiperidine?
The canonical SMILES for 2-ethyl-3-fluoro-5-methylidenepiperidine is C=C1CNC(CC)C(F)C1.
What is the InChIKey of 2-ethyl-3-fluoro-5-methylidenepiperidine?
The InChIKey is VGINOTYBNZLIAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14FN/c1-3-8-7(9)4-6(2)5-10-8/h7-8,10H,2-5H2,1H3.
What are the key properties of 2-ethyl-3-fluoro-5-methylidenepiperidine?
2-ethyl-3-fluoro-5-methylidenepiperidine has a molecular weight of 143.20 g/mol, XLogP of 1.65, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-3-fluoro-5-methylidenepiperidine is sourced from PubChem (CID 91363371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).