(2R,3R,4R,6R)-6-(2-hydroxyethyl)-3-methyl-2-phenylpiperidin-4-ol

C14H21NO2 — CID 118712103

IUPAC(2R,3R,4R,6R)-6-(2-hydroxyethyl)-3-methyl-2-phenylpiperidin-4-ol
SMILESC[C@H]1[C@H](O)C[C@@H](CCO)N[C@H]1c1ccccc1
InChIInChI=1S/C14H21NO2/c1-10-13(17)9-12(7-8-16)15-14(10)11-5-3-2-4-6-11/h2-6,10,12-17H,7-9H2,1H3/t10-,12+,13+,14+/m0/s1
InChIKeyGKCVEUIXYSHDJP-IGHBBLSQSA-N
MW235.33 g/mol
LogP1.47
Rot. Bonds3

About (2R,3R,4R,6R)-6-(2-hydroxyethyl)-3-methyl-2-phenylpiperidin-4-ol

(2R,3R,4R,6R)-6-(2-hydroxyethyl)-3-methyl-2-phenylpiperidin-4-ol (PubChem CID 118712103) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is (2R,3R,4R,6R)-6-(2-hydroxyethyl)-3-methyl-2-phenylpiperidin-4-ol.

Molecular Properties

Compound Name(2R,3R,4R,6R)-6-(2-hydroxyethyl)-3-methyl-2-phenylpiperidin-4-ol
PubChem CID118712103
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name(2R,3R,4R,6R)-6-(2-hydroxyethyl)-3-methyl-2-phenylpiperidin-4-ol
SMILESC[C@H]1[C@H](O)C[C@@H](CCO)N[C@H]1c1ccccc1
InChIInChI=1S/C14H21NO2/c1-10-13(17)9-12(7-8-16)15-14(10)11-5-3-2-4-6-11/h2-6,10,12-17H,7-9H2,1H3/t10-,12+,13+,14+/m0/s1
InChIKeyGKCVEUIXYSHDJP-IGHBBLSQSA-N
XLogP1.47
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R,3R,4R,6R)-6-(2-hydroxyethyl)-3-methyl-2-phenylpiperidin-4-ol?
The IUPAC name of (2R,3R,4R,6R)-6-(2-hydroxyethyl)-3-methyl-2-phenylpiperidin-4-ol (CID 118712103) is (2R,3R,4R,6R)-6-(2-hydroxyethyl)-3-methyl-2-phenylpiperidin-4-ol.
What is the SMILES notation for (2R,3R,4R,6R)-6-(2-hydroxyethyl)-3-methyl-2-phenylpiperidin-4-ol?
The canonical SMILES for (2R,3R,4R,6R)-6-(2-hydroxyethyl)-3-methyl-2-phenylpiperidin-4-ol is C[C@H]1[C@H](O)C[C@@H](CCO)N[C@H]1c1ccccc1.
What is the InChIKey of (2R,3R,4R,6R)-6-(2-hydroxyethyl)-3-methyl-2-phenylpiperidin-4-ol?
The InChIKey is GKCVEUIXYSHDJP-IGHBBLSQSA-N. The full InChI is InChI=1S/C14H21NO2/c1-10-13(17)9-12(7-8-16)15-14(10)11-5-3-2-4-6-11/h2-6,10,12-17H,7-9H2,1H3/t10-,12+,13+,14+/m0/s1.
What are the key properties of (2R,3R,4R,6R)-6-(2-hydroxyethyl)-3-methyl-2-phenylpiperidin-4-ol?
(2R,3R,4R,6R)-6-(2-hydroxyethyl)-3-methyl-2-phenylpiperidin-4-ol has a molecular weight of 235.33 g/mol, XLogP of 1.47, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R,4R,6R)-6-(2-hydroxyethyl)-3-methyl-2-phenylpiperidin-4-ol is sourced from PubChem (CID 118712103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).