3-(4-ethoxypiperidin-1-yl)-1-phenylpropan-1-ol

C16H25NO2 — CID 62612441

IUPAC3-(4-ethoxypiperidin-1-yl)-1-phenylpropan-1-ol
SMILESCCOC1CCN(CCC(O)c2ccccc2)CC1
InChIInChI=1S/C16H25NO2/c1-2-19-15-8-11-17(12-9-15)13-10-16(18)14-6-4-3-5-7-14/h3-7,15-16,18H,2,8-13H2,1H3
InChIKeyGBMYUPDLYSETON-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.61
Rot. Bonds6

About 3-(4-ethoxypiperidin-1-yl)-1-phenylpropan-1-ol

3-(4-ethoxypiperidin-1-yl)-1-phenylpropan-1-ol (PubChem CID 62612441) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is 3-(4-ethoxypiperidin-1-yl)-1-phenylpropan-1-ol.

Molecular Properties

Compound Name3-(4-ethoxypiperidin-1-yl)-1-phenylpropan-1-ol
PubChem CID62612441
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name3-(4-ethoxypiperidin-1-yl)-1-phenylpropan-1-ol
SMILESCCOC1CCN(CCC(O)c2ccccc2)CC1
InChIInChI=1S/C16H25NO2/c1-2-19-15-8-11-17(12-9-15)13-10-16(18)14-6-4-3-5-7-14/h3-7,15-16,18H,2,8-13H2,1H3
InChIKeyGBMYUPDLYSETON-UHFFFAOYSA-N
XLogP2.61
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(4-ethoxypiperidin-1-yl)-1-phenylpropan-1-ol?
The IUPAC name of 3-(4-ethoxypiperidin-1-yl)-1-phenylpropan-1-ol (CID 62612441) is 3-(4-ethoxypiperidin-1-yl)-1-phenylpropan-1-ol.
What is the SMILES notation for 3-(4-ethoxypiperidin-1-yl)-1-phenylpropan-1-ol?
The canonical SMILES for 3-(4-ethoxypiperidin-1-yl)-1-phenylpropan-1-ol is CCOC1CCN(CCC(O)c2ccccc2)CC1.
What is the InChIKey of 3-(4-ethoxypiperidin-1-yl)-1-phenylpropan-1-ol?
The InChIKey is GBMYUPDLYSETON-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-2-19-15-8-11-17(12-9-15)13-10-16(18)14-6-4-3-5-7-14/h3-7,15-16,18H,2,8-13H2,1H3.
What are the key properties of 3-(4-ethoxypiperidin-1-yl)-1-phenylpropan-1-ol?
3-(4-ethoxypiperidin-1-yl)-1-phenylpropan-1-ol has a molecular weight of 263.38 g/mol, XLogP of 2.61, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethoxypiperidin-1-yl)-1-phenylpropan-1-ol is sourced from PubChem (CID 62612441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).