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

C11H13ClFN — CID 24904336

IUPAC3-(3-chloro-5-fluorophenyl)piperidine
SMILESFc1cc(Cl)cc(C2CCCNC2)c1
InChIInChI=1S/C11H13ClFN/c12-10-4-9(5-11(13)6-10)8-2-1-3-14-7-8/h4-6,8,14H,1-3,7H2
InChIKeyCAFMVXFQMXDUDP-UHFFFAOYSA-N
MW213.68 g/mol
LogP2.95
Rot. Bonds1

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

3-(3-chloro-5-fluorophenyl)piperidine (PubChem CID 24904336) has the molecular formula C11H13ClFN and a molecular weight of 213.68 g/mol. Its IUPAC name is 3-(3-chloro-5-fluorophenyl)piperidine.

Molecular Properties

Compound Name3-(3-chloro-5-fluorophenyl)piperidine
PubChem CID24904336
Molecular FormulaC11H13ClFN
Molecular Weight213.68 g/mol
Exact Mass213.07
IUPAC Name3-(3-chloro-5-fluorophenyl)piperidine
SMILESFc1cc(Cl)cc(C2CCCNC2)c1
InChIInChI=1S/C11H13ClFN/c12-10-4-9(5-11(13)6-10)8-2-1-3-14-7-8/h4-6,8,14H,1-3,7H2
InChIKeyCAFMVXFQMXDUDP-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

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Related Compounds

3-(3-fluoro-5-methylphenyl)piperidine
CID 79003681
3-(3-chloro-5-iodophenyl)piperidine
CID 130001229
(3S)-3-(3-fluorophenyl)piperidine;hydrochloride
CID 45074276
3-[3,5-bis(trifluoromethyl)phenyl]piperidine
CID 45073834
3-(4-fluoro-3,5-dimethoxyphenyl)piperidine
CID 84799696
2-fluoro-5-[(3S)-piperidin-3-yl]aniline
CID 93478585
4-(3-chloro-5-fluorophenyl)-3-(2-chlorophenyl)piperidine
CID 114455081
2,4-difluoro-6-piperidin-3-ylphenol
CID 84782649
N-[(3-chloro-5-fluorophenyl)methyl]-N-(piperidin-3-ylmethyl)ethanamine
CID 106624521
2-chloro-6-methyl-4-piperidin-3-ylphenol
CID 84690213
(3S)-3-(2,5-dichlorophenyl)piperidine
CID 93478490
7-chloro-4-fluoro-2-piperidin-3-yl-1H-indole
CID 67535322

Frequently Asked Questions

What is the IUPAC name of 3-(3-chloro-5-fluorophenyl)piperidine?
The IUPAC name of 3-(3-chloro-5-fluorophenyl)piperidine (CID 24904336) is 3-(3-chloro-5-fluorophenyl)piperidine.
What is the SMILES notation for 3-(3-chloro-5-fluorophenyl)piperidine?
The canonical SMILES for 3-(3-chloro-5-fluorophenyl)piperidine is Fc1cc(Cl)cc(C2CCCNC2)c1.
What is the InChIKey of 3-(3-chloro-5-fluorophenyl)piperidine?
The InChIKey is CAFMVXFQMXDUDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13ClFN/c12-10-4-9(5-11(13)6-10)8-2-1-3-14-7-8/h4-6,8,14H,1-3,7H2.
What are the key properties of 3-(3-chloro-5-fluorophenyl)piperidine?
3-(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 3-(3-chloro-5-fluorophenyl)piperidine is sourced from PubChem (CID 24904336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).