4-benzyl-1-ethyl-4-phenoxypiperidine

C20H25NO — CID 20536567

IUPAC4-benzyl-1-ethyl-4-phenoxypiperidine
SMILESCCN1CCC(Cc2ccccc2)(Oc2ccccc2)CC1
InChIInChI=1S/C20H25NO/c1-2-21-15-13-20(14-16-21,17-18-9-5-3-6-10-18)22-19-11-7-4-8-12-19/h3-12H,2,13-17H2,1H3
InChIKeyYCBLEZVYXGGZRL-UHFFFAOYSA-N
MW295.43 g/mol
LogP4.16
Rot. Bonds5

About 4-benzyl-1-ethyl-4-phenoxypiperidine

4-benzyl-1-ethyl-4-phenoxypiperidine (PubChem CID 20536567) has the molecular formula C20H25NO and a molecular weight of 295.43 g/mol. Its IUPAC name is 4-benzyl-1-ethyl-4-phenoxypiperidine.

Molecular Properties

Compound Name4-benzyl-1-ethyl-4-phenoxypiperidine
PubChem CID20536567
Molecular FormulaC20H25NO
Molecular Weight295.43 g/mol
Exact Mass295.19
IUPAC Name4-benzyl-1-ethyl-4-phenoxypiperidine
SMILESCCN1CCC(Cc2ccccc2)(Oc2ccccc2)CC1
InChIInChI=1S/C20H25NO/c1-2-21-15-13-20(14-16-21,17-18-9-5-3-6-10-18)22-19-11-7-4-8-12-19/h3-12H,2,13-17H2,1H3
InChIKeyYCBLEZVYXGGZRL-UHFFFAOYSA-N
XLogP4.16
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-benzyl-1-ethyl-4-phenoxypiperidine?
The IUPAC name of 4-benzyl-1-ethyl-4-phenoxypiperidine (CID 20536567) is 4-benzyl-1-ethyl-4-phenoxypiperidine.
What is the SMILES notation for 4-benzyl-1-ethyl-4-phenoxypiperidine?
The canonical SMILES for 4-benzyl-1-ethyl-4-phenoxypiperidine is CCN1CCC(Cc2ccccc2)(Oc2ccccc2)CC1.
What is the InChIKey of 4-benzyl-1-ethyl-4-phenoxypiperidine?
The InChIKey is YCBLEZVYXGGZRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO/c1-2-21-15-13-20(14-16-21,17-18-9-5-3-6-10-18)22-19-11-7-4-8-12-19/h3-12H,2,13-17H2,1H3.
What are the key properties of 4-benzyl-1-ethyl-4-phenoxypiperidine?
4-benzyl-1-ethyl-4-phenoxypiperidine has a molecular weight of 295.43 g/mol, XLogP of 4.16, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzyl-1-ethyl-4-phenoxypiperidine is sourced from PubChem (CID 20536567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).