2-(1-hydroxypropyl)-1-phenylpiperidin-4-ol

C14H21NO2 — CID 67110983

IUPAC2-(1-hydroxypropyl)-1-phenylpiperidin-4-ol
SMILESCCC(O)C1CC(O)CCN1c1ccccc1
InChIInChI=1S/C14H21NO2/c1-2-14(17)13-10-12(16)8-9-15(13)11-6-4-3-5-7-11/h3-7,12-14,16-17H,2,8-10H2,1H3
InChIKeyQHEIRFVVRBIEHD-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.79
Rot. Bonds3

About 2-(1-hydroxypropyl)-1-phenylpiperidin-4-ol

2-(1-hydroxypropyl)-1-phenylpiperidin-4-ol (PubChem CID 67110983) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 2-(1-hydroxypropyl)-1-phenylpiperidin-4-ol.

Molecular Properties

Compound Name2-(1-hydroxypropyl)-1-phenylpiperidin-4-ol
PubChem CID67110983
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name2-(1-hydroxypropyl)-1-phenylpiperidin-4-ol
SMILESCCC(O)C1CC(O)CCN1c1ccccc1
InChIInChI=1S/C14H21NO2/c1-2-14(17)13-10-12(16)8-9-15(13)11-6-4-3-5-7-11/h3-7,12-14,16-17H,2,8-10H2,1H3
InChIKeyQHEIRFVVRBIEHD-UHFFFAOYSA-N
XLogP1.79
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1-hydroxypropyl)-1-phenylpiperidin-4-ol?
The IUPAC name of 2-(1-hydroxypropyl)-1-phenylpiperidin-4-ol (CID 67110983) is 2-(1-hydroxypropyl)-1-phenylpiperidin-4-ol.
What is the SMILES notation for 2-(1-hydroxypropyl)-1-phenylpiperidin-4-ol?
The canonical SMILES for 2-(1-hydroxypropyl)-1-phenylpiperidin-4-ol is CCC(O)C1CC(O)CCN1c1ccccc1.
What is the InChIKey of 2-(1-hydroxypropyl)-1-phenylpiperidin-4-ol?
The InChIKey is QHEIRFVVRBIEHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-2-14(17)13-10-12(16)8-9-15(13)11-6-4-3-5-7-11/h3-7,12-14,16-17H,2,8-10H2,1H3.
What are the key properties of 2-(1-hydroxypropyl)-1-phenylpiperidin-4-ol?
2-(1-hydroxypropyl)-1-phenylpiperidin-4-ol has a molecular weight of 235.33 g/mol, XLogP of 1.79, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-hydroxypropyl)-1-phenylpiperidin-4-ol is sourced from PubChem (CID 67110983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).