4-[[4-(2-fluoroethoxymethyl)phenyl]methoxy]piperidine

C15H22FNO2 — CID 20735353

IUPAC4-[[4-(2-fluoroethoxymethyl)phenyl]methoxy]piperidine
SMILESFCCOCc1ccc(COC2CCNCC2)cc1
InChIInChI=1S/C15H22FNO2/c16-7-10-18-11-13-1-3-14(4-2-13)12-19-15-5-8-17-9-6-15/h1-4,15,17H,5-12H2
InChIKeyXILKIEIDYKWQIV-UHFFFAOYSA-N
MW267.34 g/mol
LogP2.44
Rot. Bonds7

About 4-[[4-(2-fluoroethoxymethyl)phenyl]methoxy]piperidine

4-[[4-(2-fluoroethoxymethyl)phenyl]methoxy]piperidine (PubChem CID 20735353) has the molecular formula C15H22FNO2 and a molecular weight of 267.34 g/mol. Its IUPAC name is 4-[[4-(2-fluoroethoxymethyl)phenyl]methoxy]piperidine.

Molecular Properties

Compound Name4-[[4-(2-fluoroethoxymethyl)phenyl]methoxy]piperidine
PubChem CID20735353
Molecular FormulaC15H22FNO2
Molecular Weight267.34 g/mol
Exact Mass267.16
IUPAC Name4-[[4-(2-fluoroethoxymethyl)phenyl]methoxy]piperidine
SMILESFCCOCc1ccc(COC2CCNCC2)cc1
InChIInChI=1S/C15H22FNO2/c16-7-10-18-11-13-1-3-14(4-2-13)12-19-15-5-8-17-9-6-15/h1-4,15,17H,5-12H2
InChIKeyXILKIEIDYKWQIV-UHFFFAOYSA-N
XLogP2.44
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.34
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

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N-(cyclohexylmethyl)-2-[(2S,6R)-6-phenyloxan-2-yl]ethanamine
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CID 19960248
4-Benzyloxymethyl-piperidine
CID 6484121
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Frequently Asked Questions

What is the IUPAC name of 4-[[4-(2-fluoroethoxymethyl)phenyl]methoxy]piperidine?
The IUPAC name of 4-[[4-(2-fluoroethoxymethyl)phenyl]methoxy]piperidine (CID 20735353) is 4-[[4-(2-fluoroethoxymethyl)phenyl]methoxy]piperidine.
What is the SMILES notation for 4-[[4-(2-fluoroethoxymethyl)phenyl]methoxy]piperidine?
The canonical SMILES for 4-[[4-(2-fluoroethoxymethyl)phenyl]methoxy]piperidine is FCCOCc1ccc(COC2CCNCC2)cc1.
What is the InChIKey of 4-[[4-(2-fluoroethoxymethyl)phenyl]methoxy]piperidine?
The InChIKey is XILKIEIDYKWQIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FNO2/c16-7-10-18-11-13-1-3-14(4-2-13)12-19-15-5-8-17-9-6-15/h1-4,15,17H,5-12H2.
What are the key properties of 4-[[4-(2-fluoroethoxymethyl)phenyl]methoxy]piperidine?
4-[[4-(2-fluoroethoxymethyl)phenyl]methoxy]piperidine has a molecular weight of 267.34 g/mol, XLogP of 2.44, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[4-(2-fluoroethoxymethyl)phenyl]methoxy]piperidine is sourced from PubChem (CID 20735353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).