(2S,3S)-2-(2-phenylethyl)piperidin-3-ol

C13H19NO — CID 124505625

IUPAC(2S,3S)-2-(2-phenylethyl)piperidin-3-ol
SMILESO[C@H]1CCCN[C@H]1CCc1ccccc1
InChIInChI=1S/C13H19NO/c15-13-7-4-10-14-12(13)9-8-11-5-2-1-3-6-11/h1-3,5-6,12-15H,4,7-10H2/t12-,13-/m0/s1
InChIKeyMEMLNRRWCTXOSH-STQMWFEESA-N
MW205.30 g/mol
LogP1.73
Rot. Bonds3

About (2S,3S)-2-(2-phenylethyl)piperidin-3-ol

(2S,3S)-2-(2-phenylethyl)piperidin-3-ol (PubChem CID 124505625) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is (2S,3S)-2-(2-phenylethyl)piperidin-3-ol.

Molecular Properties

Compound Name(2S,3S)-2-(2-phenylethyl)piperidin-3-ol
PubChem CID124505625
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name(2S,3S)-2-(2-phenylethyl)piperidin-3-ol
SMILESO[C@H]1CCCN[C@H]1CCc1ccccc1
InChIInChI=1S/C13H19NO/c15-13-7-4-10-14-12(13)9-8-11-5-2-1-3-6-11/h1-3,5-6,12-15H,4,7-10H2/t12-,13-/m0/s1
InChIKeyMEMLNRRWCTXOSH-STQMWFEESA-N
XLogP1.73
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S,3S)-2-(2-phenylethyl)piperidin-3-ol?
The IUPAC name of (2S,3S)-2-(2-phenylethyl)piperidin-3-ol (CID 124505625) is (2S,3S)-2-(2-phenylethyl)piperidin-3-ol.
What is the SMILES notation for (2S,3S)-2-(2-phenylethyl)piperidin-3-ol?
The canonical SMILES for (2S,3S)-2-(2-phenylethyl)piperidin-3-ol is O[C@H]1CCCN[C@H]1CCc1ccccc1.
What is the InChIKey of (2S,3S)-2-(2-phenylethyl)piperidin-3-ol?
The InChIKey is MEMLNRRWCTXOSH-STQMWFEESA-N. The full InChI is InChI=1S/C13H19NO/c15-13-7-4-10-14-12(13)9-8-11-5-2-1-3-6-11/h1-3,5-6,12-15H,4,7-10H2/t12-,13-/m0/s1.
What are the key properties of (2S,3S)-2-(2-phenylethyl)piperidin-3-ol?
(2S,3S)-2-(2-phenylethyl)piperidin-3-ol has a molecular weight of 205.30 g/mol, XLogP of 1.73, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3S)-2-(2-phenylethyl)piperidin-3-ol is sourced from PubChem (CID 124505625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).