4-[2-(4-bromophenoxy)ethyl]piperidine

C13H18BrNO — CID 56830278

IUPAC4-[2-(4-bromophenoxy)ethyl]piperidine
SMILESBrc1ccc(OCCC2CCNCC2)cc1
InChIInChI=1S/C13H18BrNO/c14-12-1-3-13(4-2-12)16-10-7-11-5-8-15-9-6-11/h1-4,11,15H,5-10H2
InChIKeyVJCNLPWQZZOECJ-UHFFFAOYSA-N
MW284.20 g/mol
LogP3.22
Rot. Bonds4

About 4-[2-(4-bromophenoxy)ethyl]piperidine

4-[2-(4-bromophenoxy)ethyl]piperidine (PubChem CID 56830278) has the molecular formula C13H18BrNO and a molecular weight of 284.20 g/mol. Its IUPAC name is 4-[2-(4-bromophenoxy)ethyl]piperidine.

Molecular Properties

Compound Name4-[2-(4-bromophenoxy)ethyl]piperidine
PubChem CID56830278
Molecular FormulaC13H18BrNO
Molecular Weight284.20 g/mol
Exact Mass283.06
IUPAC Name4-[2-(4-bromophenoxy)ethyl]piperidine
SMILESBrc1ccc(OCCC2CCNCC2)cc1
InChIInChI=1S/C13H18BrNO/c14-12-1-3-13(4-2-12)16-10-7-11-5-8-15-9-6-11/h1-4,11,15H,5-10H2
InChIKeyVJCNLPWQZZOECJ-UHFFFAOYSA-N
XLogP3.22
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.20
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[2-(4-propan-2-ylphenoxy)ethyl]piperidine
CID 29077906
2-(4-bromophenoxy)-N-methyl-N-(piperidin-4-ylmethyl)ethanamine;hydrochloride
CID 119929603
4-[2-(4-butylphenoxy)ethyl]piperidine
CID 115492732
N-[2-(4-bromophenoxy)ethyl]-N-(piperidin-4-ylmethyl)propan-1-amine
CID 79704955
4-[2-(2,3-dihydro-1H-inden-5-yloxy)ethyl]piperidine
CID 26192461
2-amino-1-[4-(2-piperidin-4-ylethoxy)phenyl]ethanone;hydrochloride
CID 170861062
3-[2-(4-bromophenoxy)ethoxy]pyrrolidine
CID 62327569
4-[4-(2-cyclohexylethoxy)phenyl]sulfonylpiperidine
CID 59862389
butanedioate;ethane;4-(2-piperidin-4-ylethoxy)benzoate
CID 19748242
4-[3-(4-bromo-3-methylphenoxy)propyl]piperidine
CID 170313042
4-[2-(3-iodophenoxy)ethyl]piperidine
CID 105061225
4-[2-(3-methoxyphenoxy)ethyl]piperidine
CID 26192450

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-bromophenoxy)ethyl]piperidine?
The IUPAC name of 4-[2-(4-bromophenoxy)ethyl]piperidine (CID 56830278) is 4-[2-(4-bromophenoxy)ethyl]piperidine.
What is the SMILES notation for 4-[2-(4-bromophenoxy)ethyl]piperidine?
The canonical SMILES for 4-[2-(4-bromophenoxy)ethyl]piperidine is Brc1ccc(OCCC2CCNCC2)cc1.
What is the InChIKey of 4-[2-(4-bromophenoxy)ethyl]piperidine?
The InChIKey is VJCNLPWQZZOECJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18BrNO/c14-12-1-3-13(4-2-12)16-10-7-11-5-8-15-9-6-11/h1-4,11,15H,5-10H2.
What are the key properties of 4-[2-(4-bromophenoxy)ethyl]piperidine?
4-[2-(4-bromophenoxy)ethyl]piperidine has a molecular weight of 284.20 g/mol, XLogP of 3.22, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-bromophenoxy)ethyl]piperidine is sourced from PubChem (CID 56830278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).