1-(3-piperidin-2-ylphenyl)ethanol

C13H19NO — CID 117116288

IUPAC1-(3-piperidin-2-ylphenyl)ethanol
SMILESCC(O)c1cccc(C2CCCCN2)c1
InChIInChI=1S/C13H19NO/c1-10(15)11-5-4-6-12(9-11)13-7-2-3-8-14-13/h4-6,9-10,13-15H,2-3,7-8H2,1H3
InChIKeyRFWKHQSIGJLKKL-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.55
Rot. Bonds2

About 1-(3-piperidin-2-ylphenyl)ethanol

1-(3-piperidin-2-ylphenyl)ethanol (PubChem CID 117116288) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 1-(3-piperidin-2-ylphenyl)ethanol.

Molecular Properties

Compound Name1-(3-piperidin-2-ylphenyl)ethanol
PubChem CID117116288
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name1-(3-piperidin-2-ylphenyl)ethanol
SMILESCC(O)c1cccc(C2CCCCN2)c1
InChIInChI=1S/C13H19NO/c1-10(15)11-5-4-6-12(9-11)13-7-2-3-8-14-13/h4-6,9-10,13-15H,2-3,7-8H2,1H3
InChIKeyRFWKHQSIGJLKKL-UHFFFAOYSA-N
XLogP2.55
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 ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-pentan-3-ylphenyl)pyrrolidine
CID 83836317
3-[(2S)-piperidin-2-yl]phenol
CID 55277853
(2R)-2-(3-methylphenyl)azepane
CID 7048257
2-[3-(2-methylpropyl)phenyl]azepane
CID 116545597
1-[3-(piperidin-2-ylmethyl)phenyl]ethanol
CID 117118064
(2R)-2-(3-iodophenyl)piperidine
CID 7048045
(2R)-2-(3-ethenylphenyl)piperidine
CID 131060850
(2R)-2-(3-chlorophenyl)piperidine;hydrochloride
CID 154574647
2-[3-(4,4-dimethylcyclohexyl)phenyl]piperidine
CID 117431747
(2S)-2-phenylpiperidine
CID 10997356
[3-[(2R)-piperidin-2-yl]phenyl] acetate
CID 131481230
2-(3-chlorophenyl)azepane;hydrochloride
CID 46835309

Frequently Asked Questions

What is the IUPAC name of 1-(3-piperidin-2-ylphenyl)ethanol?
The IUPAC name of 1-(3-piperidin-2-ylphenyl)ethanol (CID 117116288) is 1-(3-piperidin-2-ylphenyl)ethanol.
What is the SMILES notation for 1-(3-piperidin-2-ylphenyl)ethanol?
The canonical SMILES for 1-(3-piperidin-2-ylphenyl)ethanol is CC(O)c1cccc(C2CCCCN2)c1.
What is the InChIKey of 1-(3-piperidin-2-ylphenyl)ethanol?
The InChIKey is RFWKHQSIGJLKKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-10(15)11-5-4-6-12(9-11)13-7-2-3-8-14-13/h4-6,9-10,13-15H,2-3,7-8H2,1H3.
What are the key properties of 1-(3-piperidin-2-ylphenyl)ethanol?
1-(3-piperidin-2-ylphenyl)ethanol has a molecular weight of 205.30 g/mol, XLogP of 2.55, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-piperidin-2-ylphenyl)ethanol is sourced from PubChem (CID 117116288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).