4-[2-[4-(2-methoxyethoxy)phenyl]ethyl]piperidine

C16H25NO2 — CID 165416914

IUPAC4-[2-[4-(2-methoxyethoxy)phenyl]ethyl]piperidine
SMILESCOCCOc1ccc(CCC2CCNCC2)cc1
InChIInChI=1S/C16H25NO2/c1-18-12-13-19-16-6-4-14(5-7-16)2-3-15-8-10-17-11-9-15/h4-7,15,17H,2-3,8-13H2,1H3
InChIKeyOGTJQBBETUAEJK-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.64
Rot. Bonds7

About 4-[2-[4-(2-methoxyethoxy)phenyl]ethyl]piperidine

4-[2-[4-(2-methoxyethoxy)phenyl]ethyl]piperidine (PubChem CID 165416914) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is 4-[2-[4-(2-methoxyethoxy)phenyl]ethyl]piperidine.

Molecular Properties

Compound Name4-[2-[4-(2-methoxyethoxy)phenyl]ethyl]piperidine
PubChem CID165416914
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name4-[2-[4-(2-methoxyethoxy)phenyl]ethyl]piperidine
SMILESCOCCOc1ccc(CCC2CCNCC2)cc1
InChIInChI=1S/C16H25NO2/c1-18-12-13-19-16-6-4-14(5-7-16)2-3-15-8-10-17-11-9-15/h4-7,15,17H,2-3,8-13H2,1H3
InChIKeyOGTJQBBETUAEJK-UHFFFAOYSA-N
XLogP2.64
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-[2-(4-butylphenoxy)ethyl]piperidine
CID 115492732
4-[2-(4-propan-2-yloxyphenyl)ethyl]piperidine
CID 22750908
3-[[4-(2-methoxyethyl)phenoxy]methyl]pyrrolidine
CID 55064658
2-[2-[4-(2-methoxyethoxy)phenyl]ethyl]oxirane
CID 88773200
4-[5-(4-ethoxyphenyl)pentyl]piperidine
CID 91362170
1-propoxy-4-[2-(4-propylcyclohexyl)ethyl]benzene
CID 15641416
hydron;4-[3-(4-methoxyphenyl)propyl]piperidine;chloride
CID 50986949
1-[2-(4-methylcyclohexyl)ethyl]-4-[3-(4-methylcyclohexyl)propoxy]benzene
CID 19739243
1-[2-(4-ethylcyclohexyl)ethyl]-4-[3-(4-ethylcyclohexyl)propoxy]benzene
CID 19739072
4-[2-(4-bromophenoxy)ethyl]piperidine
CID 56830278
4-[2-(4-propan-2-ylphenoxy)ethyl]piperidine
CID 29077906
2-[4-(piperidin-4-ylmethoxy)phenyl]ethanol
CID 113242079

Frequently Asked Questions

What is the IUPAC name of 4-[2-[4-(2-methoxyethoxy)phenyl]ethyl]piperidine?
The IUPAC name of 4-[2-[4-(2-methoxyethoxy)phenyl]ethyl]piperidine (CID 165416914) is 4-[2-[4-(2-methoxyethoxy)phenyl]ethyl]piperidine.
What is the SMILES notation for 4-[2-[4-(2-methoxyethoxy)phenyl]ethyl]piperidine?
The canonical SMILES for 4-[2-[4-(2-methoxyethoxy)phenyl]ethyl]piperidine is COCCOc1ccc(CCC2CCNCC2)cc1.
What is the InChIKey of 4-[2-[4-(2-methoxyethoxy)phenyl]ethyl]piperidine?
The InChIKey is OGTJQBBETUAEJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-18-12-13-19-16-6-4-14(5-7-16)2-3-15-8-10-17-11-9-15/h4-7,15,17H,2-3,8-13H2,1H3.
What are the key properties of 4-[2-[4-(2-methoxyethoxy)phenyl]ethyl]piperidine?
4-[2-[4-(2-methoxyethoxy)phenyl]ethyl]piperidine has a molecular weight of 263.38 g/mol, XLogP of 2.64, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[4-(2-methoxyethoxy)phenyl]ethyl]piperidine is sourced from PubChem (CID 165416914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).