4-[(Z)-1-(4-fluorophenyl)-2-methoxyethenyl]piperidine

C14H18FNO — CID 54767091

IUPAC4-[(Z)-1-(4-fluorophenyl)-2-methoxyethenyl]piperidine
SMILESCO/C=C(\c1ccc(F)cc1)C1CCNCC1
InChIInChI=1S/C14H18FNO/c1-17-10-14(12-6-8-16-9-7-12)11-2-4-13(15)5-3-11/h2-5,10,12,16H,6-9H2,1H3/b14-10+
InChIKeyCSBFJIIKLNHGAH-GXDHUFHOSA-N
MW235.30 g/mol
LogP2.81
Rot. Bonds3

About 4-[(Z)-1-(4-fluorophenyl)-2-methoxyethenyl]piperidine

4-[(Z)-1-(4-fluorophenyl)-2-methoxyethenyl]piperidine (PubChem CID 54767091) has the molecular formula C14H18FNO and a molecular weight of 235.30 g/mol. Its IUPAC name is 4-[(Z)-1-(4-fluorophenyl)-2-methoxyethenyl]piperidine.

Molecular Properties

Compound Name4-[(Z)-1-(4-fluorophenyl)-2-methoxyethenyl]piperidine
PubChem CID54767091
Molecular FormulaC14H18FNO
Molecular Weight235.30 g/mol
Exact Mass235.14
IUPAC Name4-[(Z)-1-(4-fluorophenyl)-2-methoxyethenyl]piperidine
SMILESCO/C=C(\c1ccc(F)cc1)C1CCNCC1
InChIInChI=1S/C14H18FNO/c1-17-10-14(12-6-8-16-9-7-12)11-2-4-13(15)5-3-11/h2-5,10,12,16H,6-9H2,1H3/b14-10+
InChIKeyCSBFJIIKLNHGAH-GXDHUFHOSA-N
XLogP2.81
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.30
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-[(Z)-1-(4-fluorophenyl)-2-methoxyethenyl]piperidine?
The IUPAC name of 4-[(Z)-1-(4-fluorophenyl)-2-methoxyethenyl]piperidine (CID 54767091) is 4-[(Z)-1-(4-fluorophenyl)-2-methoxyethenyl]piperidine.
What is the SMILES notation for 4-[(Z)-1-(4-fluorophenyl)-2-methoxyethenyl]piperidine?
The canonical SMILES for 4-[(Z)-1-(4-fluorophenyl)-2-methoxyethenyl]piperidine is CO/C=C(\c1ccc(F)cc1)C1CCNCC1.
What is the InChIKey of 4-[(Z)-1-(4-fluorophenyl)-2-methoxyethenyl]piperidine?
The InChIKey is CSBFJIIKLNHGAH-GXDHUFHOSA-N. The full InChI is InChI=1S/C14H18FNO/c1-17-10-14(12-6-8-16-9-7-12)11-2-4-13(15)5-3-11/h2-5,10,12,16H,6-9H2,1H3/b14-10+.
What are the key properties of 4-[(Z)-1-(4-fluorophenyl)-2-methoxyethenyl]piperidine?
4-[(Z)-1-(4-fluorophenyl)-2-methoxyethenyl]piperidine has a molecular weight of 235.30 g/mol, XLogP of 2.81, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(Z)-1-(4-fluorophenyl)-2-methoxyethenyl]piperidine is sourced from PubChem (CID 54767091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).