4-ethyl-1-(4-ethylphenyl)piperidine

C15H23N — CID 70847074

IUPAC4-ethyl-1-(4-ethylphenyl)piperidine
SMILESCCc1ccc(N2CCC(CC)CC2)cc1
InChIInChI=1S/C15H23N/c1-3-13-5-7-15(8-6-13)16-11-9-14(4-2)10-12-16/h5-8,14H,3-4,9-12H2,1-2H3
InChIKeyCJEFQUPPHWRUCW-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.88
Rot. Bonds3

About 4-ethyl-1-(4-ethylphenyl)piperidine

4-ethyl-1-(4-ethylphenyl)piperidine (PubChem CID 70847074) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is 4-ethyl-1-(4-ethylphenyl)piperidine.

Molecular Properties

Compound Name4-ethyl-1-(4-ethylphenyl)piperidine
PubChem CID70847074
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Name4-ethyl-1-(4-ethylphenyl)piperidine
SMILESCCc1ccc(N2CCC(CC)CC2)cc1
InChIInChI=1S/C15H23N/c1-3-13-5-7-15(8-6-13)16-11-9-14(4-2)10-12-16/h5-8,14H,3-4,9-12H2,1-2H3
InChIKeyCJEFQUPPHWRUCW-UHFFFAOYSA-N
XLogP3.88
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-1-(4-ethylphenyl)piperidine?
The IUPAC name of 4-ethyl-1-(4-ethylphenyl)piperidine (CID 70847074) is 4-ethyl-1-(4-ethylphenyl)piperidine.
What is the SMILES notation for 4-ethyl-1-(4-ethylphenyl)piperidine?
The canonical SMILES for 4-ethyl-1-(4-ethylphenyl)piperidine is CCc1ccc(N2CCC(CC)CC2)cc1.
What is the InChIKey of 4-ethyl-1-(4-ethylphenyl)piperidine?
The InChIKey is CJEFQUPPHWRUCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-3-13-5-7-15(8-6-13)16-11-9-14(4-2)10-12-16/h5-8,14H,3-4,9-12H2,1-2H3.
What are the key properties of 4-ethyl-1-(4-ethylphenyl)piperidine?
4-ethyl-1-(4-ethylphenyl)piperidine has a molecular weight of 217.36 g/mol, XLogP of 3.88, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-1-(4-ethylphenyl)piperidine is sourced from PubChem (CID 70847074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).