4-[2-(2-fluoro-5-methylphenoxy)ethyl]piperidine

C14H20FNO — CID 64854447

IUPAC4-[2-(2-fluoro-5-methylphenoxy)ethyl]piperidine
SMILESCc1ccc(F)c(OCCC2CCNCC2)c1
InChIInChI=1S/C14H20FNO/c1-11-2-3-13(15)14(10-11)17-9-6-12-4-7-16-8-5-12/h2-3,10,12,16H,4-9H2,1H3
InChIKeyPECWEONCLJETTQ-UHFFFAOYSA-N
MW237.32 g/mol
LogP2.90
Rot. Bonds4

About 4-[2-(2-fluoro-5-methylphenoxy)ethyl]piperidine

4-[2-(2-fluoro-5-methylphenoxy)ethyl]piperidine (PubChem CID 64854447) has the molecular formula C14H20FNO and a molecular weight of 237.32 g/mol. Its IUPAC name is 4-[2-(2-fluoro-5-methylphenoxy)ethyl]piperidine.

Molecular Properties

Compound Name4-[2-(2-fluoro-5-methylphenoxy)ethyl]piperidine
PubChem CID64854447
Molecular FormulaC14H20FNO
Molecular Weight237.32 g/mol
Exact Mass237.15
IUPAC Name4-[2-(2-fluoro-5-methylphenoxy)ethyl]piperidine
SMILESCc1ccc(F)c(OCCC2CCNCC2)c1
InChIInChI=1S/C14H20FNO/c1-11-2-3-13(15)14(10-11)17-9-6-12-4-7-16-8-5-12/h2-3,10,12,16H,4-9H2,1H3
InChIKeyPECWEONCLJETTQ-UHFFFAOYSA-N
XLogP2.90
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.32
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-fluoro-4-methyl-2-(4,4,4-trifluorobutoxy)benzene
CID 115518687
4-[2-(2,4-ditert-butylphenoxy)ethyl]piperidine
CID 56829654
4-[2-(2,4,5-trichlorophenoxy)ethyl]piperidine
CID 56830089
ethane;1-fluoro-4-methyl-2-propoxybenzene
CID 162531945
N-[2-(2-fluoro-5-methylphenoxy)ethyl]cyclopentanamine
CID 64854315
3-[2-(2-fluorophenoxy)ethyl]pyrrolidine;hydrochloride
CID 146064557
4-[2-(2-ethoxyphenoxy)ethyl]piperidine;hydrochloride
CID 56830114
3-[2-(2-tert-butyl-5-methylphenoxy)ethyl]azetidine
CID 107391583
4-[2-(2,4-dichloro-3,5-dimethylphenoxy)ethyl]piperidine
CID 53409973
3-[2-(2-chloro-4-methylphenoxy)ethyl]azetidine
CID 107391714
4-[(2-chloro-5-methylphenoxy)methyl]piperidine
CID 26191031
potassium [3-(2-cyclopropylethoxy)-4-fluorophenyl]-trifluoroboranuide
CID 114675089

Frequently Asked Questions

What is the IUPAC name of 4-[2-(2-fluoro-5-methylphenoxy)ethyl]piperidine?
The IUPAC name of 4-[2-(2-fluoro-5-methylphenoxy)ethyl]piperidine (CID 64854447) is 4-[2-(2-fluoro-5-methylphenoxy)ethyl]piperidine.
What is the SMILES notation for 4-[2-(2-fluoro-5-methylphenoxy)ethyl]piperidine?
The canonical SMILES for 4-[2-(2-fluoro-5-methylphenoxy)ethyl]piperidine is Cc1ccc(F)c(OCCC2CCNCC2)c1.
What is the InChIKey of 4-[2-(2-fluoro-5-methylphenoxy)ethyl]piperidine?
The InChIKey is PECWEONCLJETTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO/c1-11-2-3-13(15)14(10-11)17-9-6-12-4-7-16-8-5-12/h2-3,10,12,16H,4-9H2,1H3.
What are the key properties of 4-[2-(2-fluoro-5-methylphenoxy)ethyl]piperidine?
4-[2-(2-fluoro-5-methylphenoxy)ethyl]piperidine has a molecular weight of 237.32 g/mol, XLogP of 2.90, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2-fluoro-5-methylphenoxy)ethyl]piperidine is sourced from PubChem (CID 64854447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).