4-[(4-ethylphenyl)methyl]piperidine

C14H21N — CID 10800048

IUPAC4-[(4-ethylphenyl)methyl]piperidine
SMILESCCc1ccc(CC2CCNCC2)cc1
InChIInChI=1S/C14H21N/c1-2-12-3-5-13(6-4-12)11-14-7-9-15-10-8-14/h3-6,14-15H,2,7-11H2,1H3
InChIKeyGYGUVDCDFCXAQN-UHFFFAOYSA-N
MW203.33 g/mol
LogP2.79
Rot. Bonds3

About 4-[(4-ethylphenyl)methyl]piperidine

4-[(4-ethylphenyl)methyl]piperidine (PubChem CID 10800048) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is 4-[(4-ethylphenyl)methyl]piperidine.

Molecular Properties

Compound Name4-[(4-ethylphenyl)methyl]piperidine
PubChem CID10800048
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name4-[(4-ethylphenyl)methyl]piperidine
SMILESCCc1ccc(CC2CCNCC2)cc1
InChIInChI=1S/C14H21N/c1-2-12-3-5-13(6-4-12)11-14-7-9-15-10-8-14/h3-6,14-15H,2,7-11H2,1H3
InChIKeyGYGUVDCDFCXAQN-UHFFFAOYSA-N
XLogP2.79
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-[(4-ethylphenyl)methyl]piperidine?
The IUPAC name of 4-[(4-ethylphenyl)methyl]piperidine (CID 10800048) is 4-[(4-ethylphenyl)methyl]piperidine.
What is the SMILES notation for 4-[(4-ethylphenyl)methyl]piperidine?
The canonical SMILES for 4-[(4-ethylphenyl)methyl]piperidine is CCc1ccc(CC2CCNCC2)cc1.
What is the InChIKey of 4-[(4-ethylphenyl)methyl]piperidine?
The InChIKey is GYGUVDCDFCXAQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-2-12-3-5-13(6-4-12)11-14-7-9-15-10-8-14/h3-6,14-15H,2,7-11H2,1H3.
What are the key properties of 4-[(4-ethylphenyl)methyl]piperidine?
4-[(4-ethylphenyl)methyl]piperidine has a molecular weight of 203.33 g/mol, XLogP of 2.79, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-ethylphenyl)methyl]piperidine is sourced from PubChem (CID 10800048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).