2-(4-piperidin-1-ylphenyl)ethanol

C13H19NO — CID 3043079

IUPAC2-(4-piperidin-1-ylphenyl)ethanol
SMILESOCCc1ccc(N2CCCCC2)cc1
InChIInChI=1S/C13H19NO/c15-11-8-12-4-6-13(7-5-12)14-9-2-1-3-10-14/h4-7,15H,1-3,8-11H2
InChIKeyXHELXZZYSQOSBG-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.21
Rot. Bonds3

About 2-(4-piperidin-1-ylphenyl)ethanol

2-(4-piperidin-1-ylphenyl)ethanol (PubChem CID 3043079) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 2-(4-piperidin-1-ylphenyl)ethanol.

Molecular Properties

Compound Name2-(4-piperidin-1-ylphenyl)ethanol
PubChem CID3043079
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name2-(4-piperidin-1-ylphenyl)ethanol
SMILESOCCc1ccc(N2CCCCC2)cc1
InChIInChI=1S/C13H19NO/c15-11-8-12-4-6-13(7-5-12)14-9-2-1-3-10-14/h4-7,15H,1-3,8-11H2
InChIKeyXHELXZZYSQOSBG-UHFFFAOYSA-N
XLogP2.21
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 2-(4-piperidin-1-ylphenyl)ethanol?
The IUPAC name of 2-(4-piperidin-1-ylphenyl)ethanol (CID 3043079) is 2-(4-piperidin-1-ylphenyl)ethanol.
What is the SMILES notation for 2-(4-piperidin-1-ylphenyl)ethanol?
The canonical SMILES for 2-(4-piperidin-1-ylphenyl)ethanol is OCCc1ccc(N2CCCCC2)cc1.
What is the InChIKey of 2-(4-piperidin-1-ylphenyl)ethanol?
The InChIKey is XHELXZZYSQOSBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c15-11-8-12-4-6-13(7-5-12)14-9-2-1-3-10-14/h4-7,15H,1-3,8-11H2.
What are the key properties of 2-(4-piperidin-1-ylphenyl)ethanol?
2-(4-piperidin-1-ylphenyl)ethanol has a molecular weight of 205.30 g/mol, XLogP of 2.21, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-piperidin-1-ylphenyl)ethanol is sourced from PubChem (CID 3043079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).