4-[3-(4-fluorophenyl)-2-methylphenyl]piperidine

C18H20FN — CID 18412118

IUPAC4-[3-(4-fluorophenyl)-2-methylphenyl]piperidine
SMILESCc1c(-c2ccc(F)cc2)cccc1C1CCNCC1
InChIInChI=1S/C18H20FN/c1-13-17(14-5-7-16(19)8-6-14)3-2-4-18(13)15-9-11-20-12-10-15/h2-8,15,20H,9-12H2,1H3
InChIKeyZJAHLNVSWWCGGV-UHFFFAOYSA-N
MW269.36 g/mol
LogP4.27
Rot. Bonds2

About 4-[3-(4-fluorophenyl)-2-methylphenyl]piperidine

4-[3-(4-fluorophenyl)-2-methylphenyl]piperidine (PubChem CID 18412118) has the molecular formula C18H20FN and a molecular weight of 269.36 g/mol. Its IUPAC name is 4-[3-(4-fluorophenyl)-2-methylphenyl]piperidine.

Molecular Properties

Compound Name4-[3-(4-fluorophenyl)-2-methylphenyl]piperidine
PubChem CID18412118
Molecular FormulaC18H20FN
Molecular Weight269.36 g/mol
Exact Mass269.16
IUPAC Name4-[3-(4-fluorophenyl)-2-methylphenyl]piperidine
SMILESCc1c(-c2ccc(F)cc2)cccc1C1CCNCC1
InChIInChI=1S/C18H20FN/c1-13-17(14-5-7-16(19)8-6-14)3-2-4-18(13)15-9-11-20-12-10-15/h2-8,15,20H,9-12H2,1H3
InChIKeyZJAHLNVSWWCGGV-UHFFFAOYSA-N
XLogP4.27
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.36
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-[3-(4-fluorophenyl)-2-methylphenyl]piperidine?
The IUPAC name of 4-[3-(4-fluorophenyl)-2-methylphenyl]piperidine (CID 18412118) is 4-[3-(4-fluorophenyl)-2-methylphenyl]piperidine.
What is the SMILES notation for 4-[3-(4-fluorophenyl)-2-methylphenyl]piperidine?
The canonical SMILES for 4-[3-(4-fluorophenyl)-2-methylphenyl]piperidine is Cc1c(-c2ccc(F)cc2)cccc1C1CCNCC1.
What is the InChIKey of 4-[3-(4-fluorophenyl)-2-methylphenyl]piperidine?
The InChIKey is ZJAHLNVSWWCGGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FN/c1-13-17(14-5-7-16(19)8-6-14)3-2-4-18(13)15-9-11-20-12-10-15/h2-8,15,20H,9-12H2,1H3.
What are the key properties of 4-[3-(4-fluorophenyl)-2-methylphenyl]piperidine?
4-[3-(4-fluorophenyl)-2-methylphenyl]piperidine has a molecular weight of 269.36 g/mol, XLogP of 4.27, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(4-fluorophenyl)-2-methylphenyl]piperidine is sourced from PubChem (CID 18412118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).