2-(1-piperidin-4-ylethyl)phenol

C13H19NO — CID 83908775

IUPAC2-(1-piperidin-4-ylethyl)phenol
SMILESCC(c1ccccc1O)C1CCNCC1
InChIInChI=1S/C13H19NO/c1-10(11-6-8-14-9-7-11)12-4-2-3-5-13(12)15/h2-5,10-11,14-15H,6-9H2,1H3
InChIKeyZASXCKPVJMBIFU-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.50
Rot. Bonds2

About 2-(1-piperidin-4-ylethyl)phenol

2-(1-piperidin-4-ylethyl)phenol (PubChem CID 83908775) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 2-(1-piperidin-4-ylethyl)phenol.

Molecular Properties

Compound Name2-(1-piperidin-4-ylethyl)phenol
PubChem CID83908775
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name2-(1-piperidin-4-ylethyl)phenol
SMILESCC(c1ccccc1O)C1CCNCC1
InChIInChI=1S/C13H19NO/c1-10(11-6-8-14-9-7-11)12-4-2-3-5-13(12)15/h2-5,10-11,14-15H,6-9H2,1H3
InChIKeyZASXCKPVJMBIFU-UHFFFAOYSA-N
XLogP2.50
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(1-piperidin-4-ylethyl)phenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(1-piperidin-4-ylethyl)phenol?
The IUPAC name of 2-(1-piperidin-4-ylethyl)phenol (CID 83908775) is 2-(1-piperidin-4-ylethyl)phenol.
What is the SMILES notation for 2-(1-piperidin-4-ylethyl)phenol?
The canonical SMILES for 2-(1-piperidin-4-ylethyl)phenol is CC(c1ccccc1O)C1CCNCC1.
What is the InChIKey of 2-(1-piperidin-4-ylethyl)phenol?
The InChIKey is ZASXCKPVJMBIFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-10(11-6-8-14-9-7-11)12-4-2-3-5-13(12)15/h2-5,10-11,14-15H,6-9H2,1H3.
What are the key properties of 2-(1-piperidin-4-ylethyl)phenol?
2-(1-piperidin-4-ylethyl)phenol has a molecular weight of 205.30 g/mol, XLogP of 2.50, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-piperidin-4-ylethyl)phenol is sourced from PubChem (CID 83908775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).