4-(3-chloro-5-fluorophenyl)piperidine

C11H13ClFN — CID 16679319

IUPAC4-(3-chloro-5-fluorophenyl)piperidine
SMILESFc1cc(Cl)cc(C2CCNCC2)c1
InChIInChI=1S/C11H13ClFN/c12-10-5-9(6-11(13)7-10)8-1-3-14-4-2-8/h5-8,14H,1-4H2
InChIKeyGMFIXURXPROPOV-UHFFFAOYSA-N
MW213.68 g/mol
LogP2.95
Rot. Bonds1

About 4-(3-chloro-5-fluorophenyl)piperidine

4-(3-chloro-5-fluorophenyl)piperidine (PubChem CID 16679319) has the molecular formula C11H13ClFN and a molecular weight of 213.68 g/mol. Its IUPAC name is 4-(3-chloro-5-fluorophenyl)piperidine.

Molecular Properties

Compound Name4-(3-chloro-5-fluorophenyl)piperidine
PubChem CID16679319
Molecular FormulaC11H13ClFN
Molecular Weight213.68 g/mol
Exact Mass213.07
IUPAC Name4-(3-chloro-5-fluorophenyl)piperidine
SMILESFc1cc(Cl)cc(C2CCNCC2)c1
InChIInChI=1S/C11H13ClFN/c12-10-5-9(6-11(13)7-10)8-1-3-14-4-2-8/h5-8,14H,1-4H2
InChIKeyGMFIXURXPROPOV-UHFFFAOYSA-N
XLogP2.95
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.68
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 4-(3-chloro-5-fluorophenyl)piperidine 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-(3-chloro-5-fluorophenyl)piperidine?
The IUPAC name of 4-(3-chloro-5-fluorophenyl)piperidine (CID 16679319) is 4-(3-chloro-5-fluorophenyl)piperidine.
What is the SMILES notation for 4-(3-chloro-5-fluorophenyl)piperidine?
The canonical SMILES for 4-(3-chloro-5-fluorophenyl)piperidine is Fc1cc(Cl)cc(C2CCNCC2)c1.
What is the InChIKey of 4-(3-chloro-5-fluorophenyl)piperidine?
The InChIKey is GMFIXURXPROPOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13ClFN/c12-10-5-9(6-11(13)7-10)8-1-3-14-4-2-8/h5-8,14H,1-4H2.
What are the key properties of 4-(3-chloro-5-fluorophenyl)piperidine?
4-(3-chloro-5-fluorophenyl)piperidine has a molecular weight of 213.68 g/mol, XLogP of 2.95, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-chloro-5-fluorophenyl)piperidine is sourced from PubChem (CID 16679319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).