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

C16H25NO — CID 56830188

IUPAC4-[2-(2-propylphenoxy)ethyl]piperidine
SMILESCCCc1ccccc1OCCC1CCNCC1
InChIInChI=1S/C16H25NO/c1-2-5-15-6-3-4-7-16(15)18-13-10-14-8-11-17-12-9-14/h3-4,6-7,14,17H,2,5,8-13H2,1H3
InChIKeyNJFUJAFZOFFLCY-UHFFFAOYSA-N
MW247.38 g/mol
LogP3.41
Rot. Bonds6

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

4-[2-(2-propylphenoxy)ethyl]piperidine (PubChem CID 56830188) has the molecular formula C16H25NO and a molecular weight of 247.38 g/mol. Its IUPAC name is 4-[2-(2-propylphenoxy)ethyl]piperidine.

Molecular Properties

Compound Name4-[2-(2-propylphenoxy)ethyl]piperidine
PubChem CID56830188
Molecular FormulaC16H25NO
Molecular Weight247.38 g/mol
Exact Mass247.19
IUPAC Name4-[2-(2-propylphenoxy)ethyl]piperidine
SMILESCCCc1ccccc1OCCC1CCNCC1
InChIInChI=1S/C16H25NO/c1-2-5-15-6-3-4-7-16(15)18-13-10-14-8-11-17-12-9-14/h3-4,6-7,14,17H,2,5,8-13H2,1H3
InChIKeyNJFUJAFZOFFLCY-UHFFFAOYSA-N
XLogP3.41
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.38
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(2-propylphenoxy)ethyl]piperidine?
The IUPAC name of 4-[2-(2-propylphenoxy)ethyl]piperidine (CID 56830188) is 4-[2-(2-propylphenoxy)ethyl]piperidine.
What is the SMILES notation for 4-[2-(2-propylphenoxy)ethyl]piperidine?
The canonical SMILES for 4-[2-(2-propylphenoxy)ethyl]piperidine is CCCc1ccccc1OCCC1CCNCC1.
What is the InChIKey of 4-[2-(2-propylphenoxy)ethyl]piperidine?
The InChIKey is NJFUJAFZOFFLCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO/c1-2-5-15-6-3-4-7-16(15)18-13-10-14-8-11-17-12-9-14/h3-4,6-7,14,17H,2,5,8-13H2,1H3.
What are the key properties of 4-[2-(2-propylphenoxy)ethyl]piperidine?
4-[2-(2-propylphenoxy)ethyl]piperidine has a molecular weight of 247.38 g/mol, XLogP of 3.41, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2-propylphenoxy)ethyl]piperidine is sourced from PubChem (CID 56830188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).