4-[(4-fluorophenyl)methyl]-1-methylpiperidine

C13H18FN — CID 14947166

IUPAC4-[(4-fluorophenyl)methyl]-1-methylpiperidine
SMILESCN1CCC(Cc2ccc(F)cc2)CC1
InChIInChI=1S/C13H18FN/c1-15-8-6-12(7-9-15)10-11-2-4-13(14)5-3-11/h2-5,12H,6-10H2,1H3
InChIKeyRXTRGKQVEMZDIB-UHFFFAOYSA-N
MW207.29 g/mol
LogP2.71
Rot. Bonds2

About 4-[(4-fluorophenyl)methyl]-1-methylpiperidine

4-[(4-fluorophenyl)methyl]-1-methylpiperidine (PubChem CID 14947166) has the molecular formula C13H18FN and a molecular weight of 207.29 g/mol. Its IUPAC name is 4-[(4-fluorophenyl)methyl]-1-methylpiperidine.

Molecular Properties

Compound Name4-[(4-fluorophenyl)methyl]-1-methylpiperidine
PubChem CID14947166
Molecular FormulaC13H18FN
Molecular Weight207.29 g/mol
Exact Mass207.14
IUPAC Name4-[(4-fluorophenyl)methyl]-1-methylpiperidine
SMILESCN1CCC(Cc2ccc(F)cc2)CC1
InChIInChI=1S/C13H18FN/c1-15-8-6-12(7-9-15)10-11-2-4-13(14)5-3-11/h2-5,12H,6-10H2,1H3
InChIKeyRXTRGKQVEMZDIB-UHFFFAOYSA-N
XLogP2.71
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.29
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 4-[(4-fluorophenyl)methyl]-1-methylpiperidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[(4-fluorophenyl)methyl]-1-methylpiperidine?
The IUPAC name of 4-[(4-fluorophenyl)methyl]-1-methylpiperidine (CID 14947166) is 4-[(4-fluorophenyl)methyl]-1-methylpiperidine.
What is the SMILES notation for 4-[(4-fluorophenyl)methyl]-1-methylpiperidine?
The canonical SMILES for 4-[(4-fluorophenyl)methyl]-1-methylpiperidine is CN1CCC(Cc2ccc(F)cc2)CC1.
What is the InChIKey of 4-[(4-fluorophenyl)methyl]-1-methylpiperidine?
The InChIKey is RXTRGKQVEMZDIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18FN/c1-15-8-6-12(7-9-15)10-11-2-4-13(14)5-3-11/h2-5,12H,6-10H2,1H3.
What are the key properties of 4-[(4-fluorophenyl)methyl]-1-methylpiperidine?
4-[(4-fluorophenyl)methyl]-1-methylpiperidine has a molecular weight of 207.29 g/mol, XLogP of 2.71, 2 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-methylpiperidine is sourced from PubChem (CID 14947166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).