2-phenylethanol;piperidine

C13H21NO — CID 143551130

IUPAC2-phenylethanol;piperidine
SMILESC1CCNCC1.OCCc1ccccc1
InChIInChI=1S/C8H10O.C5H11N/c9-7-6-8-4-2-1-3-5-8;1-2-4-6-5-3-1/h1-5,9H,6-7H2;6H,1-5H2
InChIKeyCIPWKNQJMYXGDU-UHFFFAOYSA-N
MW207.32 g/mol
LogP1.98
Rot. Bonds2

About 2-phenylethanol;piperidine

2-phenylethanol;piperidine (PubChem CID 143551130) has the molecular formula C13H21NO and a molecular weight of 207.32 g/mol. Its IUPAC name is 2-phenylethanol;piperidine.

Molecular Properties

Compound Name2-phenylethanol;piperidine
PubChem CID143551130
Molecular FormulaC13H21NO
Molecular Weight207.32 g/mol
Exact Mass207.16
IUPAC Name2-phenylethanol;piperidine
SMILESC1CCNCC1.OCCc1ccccc1
InChIInChI=1S/C8H10O.C5H11N/c9-7-6-8-4-2-1-3-5-8;1-2-4-6-5-3-1/h1-5,9H,6-7H2;6H,1-5H2
InChIKeyCIPWKNQJMYXGDU-UHFFFAOYSA-N
XLogP1.98
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-phenylethanol;piperidine?
The IUPAC name of 2-phenylethanol;piperidine (CID 143551130) is 2-phenylethanol;piperidine.
What is the SMILES notation for 2-phenylethanol;piperidine?
The canonical SMILES for 2-phenylethanol;piperidine is C1CCNCC1.OCCc1ccccc1.
What is the InChIKey of 2-phenylethanol;piperidine?
The InChIKey is CIPWKNQJMYXGDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10O.C5H11N/c9-7-6-8-4-2-1-3-5-8;1-2-4-6-5-3-1/h1-5,9H,6-7H2;6H,1-5H2.
What are the key properties of 2-phenylethanol;piperidine?
2-phenylethanol;piperidine has a molecular weight of 207.32 g/mol, XLogP of 1.98, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylethanol;piperidine is sourced from PubChem (CID 143551130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).