4-[[2-(4-chlorophenyl)phenyl]methyl]-4-fluoropiperidine

C18H19ClFN — CID 67126512

IUPAC4-[[2-(4-chlorophenyl)phenyl]methyl]-4-fluoropiperidine
SMILESFC1(Cc2ccccc2-c2ccc(Cl)cc2)CCNCC1
InChIInChI=1S/C18H19ClFN/c19-16-7-5-14(6-8-16)17-4-2-1-3-15(17)13-18(20)9-11-21-12-10-18/h1-8,21H,9-13H2
InChIKeyWXQGUXQFCYBPIN-UHFFFAOYSA-N
MW303.81 g/mol
LogP4.64
Rot. Bonds3

About 4-[[2-(4-chlorophenyl)phenyl]methyl]-4-fluoropiperidine

4-[[2-(4-chlorophenyl)phenyl]methyl]-4-fluoropiperidine (PubChem CID 67126512) has the molecular formula C18H19ClFN and a molecular weight of 303.81 g/mol. Its IUPAC name is 4-[[2-(4-chlorophenyl)phenyl]methyl]-4-fluoropiperidine.

Molecular Properties

Compound Name4-[[2-(4-chlorophenyl)phenyl]methyl]-4-fluoropiperidine
PubChem CID67126512
Molecular FormulaC18H19ClFN
Molecular Weight303.81 g/mol
Exact Mass303.12
IUPAC Name4-[[2-(4-chlorophenyl)phenyl]methyl]-4-fluoropiperidine
SMILESFC1(Cc2ccccc2-c2ccc(Cl)cc2)CCNCC1
InChIInChI=1S/C18H19ClFN/c19-16-7-5-14(6-8-16)17-4-2-1-3-15(17)13-18(20)9-11-21-12-10-18/h1-8,21H,9-13H2
InChIKeyWXQGUXQFCYBPIN-UHFFFAOYSA-N
XLogP4.64
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.81
LogP ≤ 54.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-[[2-(4-chlorophenyl)phenyl]methyl]-4-fluoropiperidine?
The IUPAC name of 4-[[2-(4-chlorophenyl)phenyl]methyl]-4-fluoropiperidine (CID 67126512) is 4-[[2-(4-chlorophenyl)phenyl]methyl]-4-fluoropiperidine.
What is the SMILES notation for 4-[[2-(4-chlorophenyl)phenyl]methyl]-4-fluoropiperidine?
The canonical SMILES for 4-[[2-(4-chlorophenyl)phenyl]methyl]-4-fluoropiperidine is FC1(Cc2ccccc2-c2ccc(Cl)cc2)CCNCC1.
What is the InChIKey of 4-[[2-(4-chlorophenyl)phenyl]methyl]-4-fluoropiperidine?
The InChIKey is WXQGUXQFCYBPIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19ClFN/c19-16-7-5-14(6-8-16)17-4-2-1-3-15(17)13-18(20)9-11-21-12-10-18/h1-8,21H,9-13H2.
What are the key properties of 4-[[2-(4-chlorophenyl)phenyl]methyl]-4-fluoropiperidine?
4-[[2-(4-chlorophenyl)phenyl]methyl]-4-fluoropiperidine has a molecular weight of 303.81 g/mol, XLogP of 4.64, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(4-chlorophenyl)phenyl]methyl]-4-fluoropiperidine is sourced from PubChem (CID 67126512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).