4-(2-chlorophenyl)-3-(4-fluorophenyl)piperidine

C17H17ClFN — CID 79435303

IUPAC4-(2-chlorophenyl)-3-(4-fluorophenyl)piperidine
SMILESFc1ccc(C2CNCCC2c2ccccc2Cl)cc1
InChIInChI=1S/C17H17ClFN/c18-17-4-2-1-3-15(17)14-9-10-20-11-16(14)12-5-7-13(19)8-6-12/h1-8,14,16,20H,9-11H2
InChIKeyYBSHJIZCIMCOER-UHFFFAOYSA-N
MW289.78 g/mol
LogP4.34
Rot. Bonds2

About 4-(2-chlorophenyl)-3-(4-fluorophenyl)piperidine

4-(2-chlorophenyl)-3-(4-fluorophenyl)piperidine (PubChem CID 79435303) has the molecular formula C17H17ClFN and a molecular weight of 289.78 g/mol. Its IUPAC name is 4-(2-chlorophenyl)-3-(4-fluorophenyl)piperidine.

Molecular Properties

Compound Name4-(2-chlorophenyl)-3-(4-fluorophenyl)piperidine
PubChem CID79435303
Molecular FormulaC17H17ClFN
Molecular Weight289.78 g/mol
Exact Mass289.10
IUPAC Name4-(2-chlorophenyl)-3-(4-fluorophenyl)piperidine
SMILESFc1ccc(C2CNCCC2c2ccccc2Cl)cc1
InChIInChI=1S/C17H17ClFN/c18-17-4-2-1-3-15(17)14-9-10-20-11-16(14)12-5-7-13(19)8-6-12/h1-8,14,16,20H,9-11H2
InChIKeyYBSHJIZCIMCOER-UHFFFAOYSA-N
XLogP4.34
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.78
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-(3-chloro-2-fluorophenyl)-3-(4-chlorophenyl)piperidine
CID 114489277
4-(5-chloro-2-fluorophenyl)-3-(4-fluorophenyl)piperidine
CID 114867305
4-(3-chloro-5-fluorophenyl)-3-(2-chlorophenyl)piperidine
CID 114455081
3-(3-bromophenyl)-4-(2-chlorophenyl)piperidine
CID 79430057
3-(2-chlorophenyl)-4-(3,5-dichlorophenyl)piperidine
CID 79439665
3-(2-chlorophenyl)-4-(2-ethylphenyl)piperidine
CID 79439447
3,4-bis(4-chlorophenyl)piperidine
CID 79434307
3-(4-chlorophenyl)-4-(2,6-difluorophenyl)piperidine
CID 79433603
3-(3-chlorophenyl)-4-(2,4-difluorophenyl)piperidine
CID 79434014
4-(3,4-dichlorophenyl)-3-(2-fluorophenyl)piperidine
CID 79440006
3-[3-(2-chlorophenyl)piperidin-4-yl]pyridine
CID 79454588
3-(4-fluorophenyl)-4-(4-methoxyphenyl)piperidine
CID 79433103

Frequently Asked Questions

What is the IUPAC name of 4-(2-chlorophenyl)-3-(4-fluorophenyl)piperidine?
The IUPAC name of 4-(2-chlorophenyl)-3-(4-fluorophenyl)piperidine (CID 79435303) is 4-(2-chlorophenyl)-3-(4-fluorophenyl)piperidine.
What is the SMILES notation for 4-(2-chlorophenyl)-3-(4-fluorophenyl)piperidine?
The canonical SMILES for 4-(2-chlorophenyl)-3-(4-fluorophenyl)piperidine is Fc1ccc(C2CNCCC2c2ccccc2Cl)cc1.
What is the InChIKey of 4-(2-chlorophenyl)-3-(4-fluorophenyl)piperidine?
The InChIKey is YBSHJIZCIMCOER-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17ClFN/c18-17-4-2-1-3-15(17)14-9-10-20-11-16(14)12-5-7-13(19)8-6-12/h1-8,14,16,20H,9-11H2.
What are the key properties of 4-(2-chlorophenyl)-3-(4-fluorophenyl)piperidine?
4-(2-chlorophenyl)-3-(4-fluorophenyl)piperidine has a molecular weight of 289.78 g/mol, XLogP of 4.34, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-chlorophenyl)-3-(4-fluorophenyl)piperidine is sourced from PubChem (CID 79435303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).