4-[(4-fluorophenyl)methyl]-1-(2-phenylethyl)piperidine

C20H24FN — CID 10017543

IUPAC4-[(4-fluorophenyl)methyl]-1-(2-phenylethyl)piperidine
SMILESFc1ccc(CC2CCN(CCc3ccccc3)CC2)cc1
InChIInChI=1S/C20H24FN/c21-20-8-6-18(7-9-20)16-19-11-14-22(15-12-19)13-10-17-4-2-1-3-5-17/h1-9,19H,10-16H2
InChIKeyJZGMVBMAZLGESV-UHFFFAOYSA-N
MW297.42 g/mol
LogP4.32
Rot. Bonds5

About 4-[(4-fluorophenyl)methyl]-1-(2-phenylethyl)piperidine

4-[(4-fluorophenyl)methyl]-1-(2-phenylethyl)piperidine (PubChem CID 10017543) has the molecular formula C20H24FN and a molecular weight of 297.42 g/mol. Its IUPAC name is 4-[(4-fluorophenyl)methyl]-1-(2-phenylethyl)piperidine.

Molecular Properties

Compound Name4-[(4-fluorophenyl)methyl]-1-(2-phenylethyl)piperidine
PubChem CID10017543
Molecular FormulaC20H24FN
Molecular Weight297.42 g/mol
Exact Mass297.19
IUPAC Name4-[(4-fluorophenyl)methyl]-1-(2-phenylethyl)piperidine
SMILESFc1ccc(CC2CCN(CCc3ccccc3)CC2)cc1
InChIInChI=1S/C20H24FN/c21-20-8-6-18(7-9-20)16-19-11-14-22(15-12-19)13-10-17-4-2-1-3-5-17/h1-9,19H,10-16H2
InChIKeyJZGMVBMAZLGESV-UHFFFAOYSA-N
XLogP4.32
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.42
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-[(4-fluorophenyl)methyl]-1-(2-phenylethyl)piperidine?
The IUPAC name of 4-[(4-fluorophenyl)methyl]-1-(2-phenylethyl)piperidine (CID 10017543) is 4-[(4-fluorophenyl)methyl]-1-(2-phenylethyl)piperidine.
What is the SMILES notation for 4-[(4-fluorophenyl)methyl]-1-(2-phenylethyl)piperidine?
The canonical SMILES for 4-[(4-fluorophenyl)methyl]-1-(2-phenylethyl)piperidine is Fc1ccc(CC2CCN(CCc3ccccc3)CC2)cc1.
What is the InChIKey of 4-[(4-fluorophenyl)methyl]-1-(2-phenylethyl)piperidine?
The InChIKey is JZGMVBMAZLGESV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24FN/c21-20-8-6-18(7-9-20)16-19-11-14-22(15-12-19)13-10-17-4-2-1-3-5-17/h1-9,19H,10-16H2.
What are the key properties of 4-[(4-fluorophenyl)methyl]-1-(2-phenylethyl)piperidine?
4-[(4-fluorophenyl)methyl]-1-(2-phenylethyl)piperidine has a molecular weight of 297.42 g/mol, XLogP of 4.32, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-fluorophenyl)methyl]-1-(2-phenylethyl)piperidine is sourced from PubChem (CID 10017543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).