1-fluoro-4-propan-2-ylidenepiperidine

C8H14FN — CID 166075217

IUPAC1-fluoro-4-propan-2-ylidenepiperidine
SMILESCC(C)=C1CCN(F)CC1
InChIInChI=1S/C8H14FN/c1-7(2)8-3-5-10(9)6-4-8/h3-6H2,1-2H3
InChIKeyAZRLVBGOCCHXHR-UHFFFAOYSA-N
MW143.20 g/mol
LogP2.30
Rot. Bonds

About 1-fluoro-4-propan-2-ylidenepiperidine

1-fluoro-4-propan-2-ylidenepiperidine (PubChem CID 166075217) has the molecular formula C8H14FN and a molecular weight of 143.20 g/mol. Its IUPAC name is 1-fluoro-4-propan-2-ylidenepiperidine.

Molecular Properties

Compound Name1-fluoro-4-propan-2-ylidenepiperidine
PubChem CID166075217
Molecular FormulaC8H14FN
Molecular Weight143.20 g/mol
Exact Mass143.11
IUPAC Name1-fluoro-4-propan-2-ylidenepiperidine
SMILESCC(C)=C1CCN(F)CC1
InChIInChI=1S/C8H14FN/c1-7(2)8-3-5-10(9)6-4-8/h3-6H2,1-2H3
InChIKeyAZRLVBGOCCHXHR-UHFFFAOYSA-N
XLogP2.30
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.20
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-Methyl-4-(1-methylethylidene)-piperidine
CID 18715669
4-Cyclopropylidene-1-methylpiperidine
CID 134860489
4-(1-Fluoroethylidene)-1-methylpiperidine
CID 20612504
4-Butan-2-ylidene-1-(2-fluoro-2-methylpropyl)piperidine
CID 169614755
3-Fluoro-1-methyl-4-propan-2-ylidenepiperidine
CID 169625533
1-Ethyl-4-(1-fluoroethylidene)piperidine
CID 173019159
4-Ethylidene-1-methylpiperidine
CID 18713410
1-Propan-2-yl-4-propan-2-ylidenepiperidine
CID 58355811
1-Ethyl-4-propan-2-ylidenepiperidine
CID 91053398
Deuteriomethane;ethane;1-methyl-4-propan-2-ylidenepiperidine
CID 91245726
4-Methyl-1-azabicyclo[3.2.2]non-4-ene
CID 123161508
1-Methyl-3-propan-2-ylidenepiperidine
CID 134228663

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-4-propan-2-ylidenepiperidine?
The IUPAC name of 1-fluoro-4-propan-2-ylidenepiperidine (CID 166075217) is 1-fluoro-4-propan-2-ylidenepiperidine.
What is the SMILES notation for 1-fluoro-4-propan-2-ylidenepiperidine?
The canonical SMILES for 1-fluoro-4-propan-2-ylidenepiperidine is CC(C)=C1CCN(F)CC1.
What is the InChIKey of 1-fluoro-4-propan-2-ylidenepiperidine?
The InChIKey is AZRLVBGOCCHXHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14FN/c1-7(2)8-3-5-10(9)6-4-8/h3-6H2,1-2H3.
What are the key properties of 1-fluoro-4-propan-2-ylidenepiperidine?
1-fluoro-4-propan-2-ylidenepiperidine has a molecular weight of 143.20 g/mol, XLogP of 2.30, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-4-propan-2-ylidenepiperidine is sourced from PubChem (CID 166075217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).