(2R)-2-[(2R,3R)-3-(hydroxymethyl)-2-methylpiperidin-1-yl]-2-phenylethanol

C15H23NO2 — CID 143702380

IUPAC(2R)-2-[(2R,3R)-3-(hydroxymethyl)-2-methylpiperidin-1-yl]-2-phenylethanol
SMILESC[C@@H]1[C@H](CO)CCCN1[C@@H](CO)c1ccccc1
InChIInChI=1S/C15H23NO2/c1-12-14(10-17)8-5-9-16(12)15(11-18)13-6-3-2-4-7-13/h2-4,6-7,12,14-15,17-18H,5,8-11H2,1H3/t12-,14+,15+/m1/s1
InChIKeyCJQSHYPUEFNGBY-SNPRPXQTSA-N
MW249.35 g/mol
LogP1.81
Rot. Bonds4

About (2R)-2-[(2R,3R)-3-(hydroxymethyl)-2-methylpiperidin-1-yl]-2-phenylethanol

(2R)-2-[(2R,3R)-3-(hydroxymethyl)-2-methylpiperidin-1-yl]-2-phenylethanol (PubChem CID 143702380) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is (2R)-2-[(2R,3R)-3-(hydroxymethyl)-2-methylpiperidin-1-yl]-2-phenylethanol.

Molecular Properties

Compound Name(2R)-2-[(2R,3R)-3-(hydroxymethyl)-2-methylpiperidin-1-yl]-2-phenylethanol
PubChem CID143702380
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name(2R)-2-[(2R,3R)-3-(hydroxymethyl)-2-methylpiperidin-1-yl]-2-phenylethanol
SMILESC[C@@H]1[C@H](CO)CCCN1[C@@H](CO)c1ccccc1
InChIInChI=1S/C15H23NO2/c1-12-14(10-17)8-5-9-16(12)15(11-18)13-6-3-2-4-7-13/h2-4,6-7,12,14-15,17-18H,5,8-11H2,1H3/t12-,14+,15+/m1/s1
InChIKeyCJQSHYPUEFNGBY-SNPRPXQTSA-N
XLogP1.81
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2R)-2-[(2R,3R)-3-(hydroxymethyl)-2-methylpiperidin-1-yl]-2-phenylethanol with MolForge

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

Launch Full Analysis

Related Compounds

2-(2-methylazetidin-1-yl)-2-phenylethanol
CID 104549553
(2S)-2-[(2S)-2-ethylpiperidin-1-yl]-2-phenylethanol
CID 10609696
(2S)-2-[(2S,3R)-3-(tert-butylamino)-2-methylpyrrolidin-1-yl]-2-phenylethanol
CID 10446176
(2S)-2-phenyl-2-[(2S)-2-propylpiperidin-1-yl]ethanol
CID 10490739
3-(2,3-dimethylpiperidin-1-yl)-3-phenylpropan-1-amine
CID 62779217
methyl 2-[(2S)-1-[(1R)-2-hydroxy-1-phenylethyl]pyrrolidin-2-yl]prop-2-enoate
CID 134900684
(2R)-2-[(6R)-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-2-phenylethanol
CID 10680302
(2R)-2-[(2S)-2-pentylpiperidin-1-yl]-2-phenylethanol
CID 10636143
[(2S)-1-(1-phenylethyl)pyrrolidin-2-yl]methanol
CID 66261742
N'-hydroxy-3-[2-(hydroxymethyl)piperidin-1-yl]-3-phenylpropanimidamide
CID 76949180
3-[2-(hydroxymethyl)piperidin-1-yl]-3-phenylpropanethioamide
CID 62779946
3-(2-methylpyrrolidin-1-yl)-2-phenylpropan-1-ol
CID 53416012

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(2R,3R)-3-(hydroxymethyl)-2-methylpiperidin-1-yl]-2-phenylethanol?
The IUPAC name of (2R)-2-[(2R,3R)-3-(hydroxymethyl)-2-methylpiperidin-1-yl]-2-phenylethanol (CID 143702380) is (2R)-2-[(2R,3R)-3-(hydroxymethyl)-2-methylpiperidin-1-yl]-2-phenylethanol.
What is the SMILES notation for (2R)-2-[(2R,3R)-3-(hydroxymethyl)-2-methylpiperidin-1-yl]-2-phenylethanol?
The canonical SMILES for (2R)-2-[(2R,3R)-3-(hydroxymethyl)-2-methylpiperidin-1-yl]-2-phenylethanol is C[C@@H]1[C@H](CO)CCCN1[C@@H](CO)c1ccccc1.
What is the InChIKey of (2R)-2-[(2R,3R)-3-(hydroxymethyl)-2-methylpiperidin-1-yl]-2-phenylethanol?
The InChIKey is CJQSHYPUEFNGBY-SNPRPXQTSA-N. The full InChI is InChI=1S/C15H23NO2/c1-12-14(10-17)8-5-9-16(12)15(11-18)13-6-3-2-4-7-13/h2-4,6-7,12,14-15,17-18H,5,8-11H2,1H3/t12-,14+,15+/m1/s1.
What are the key properties of (2R)-2-[(2R,3R)-3-(hydroxymethyl)-2-methylpiperidin-1-yl]-2-phenylethanol?
(2R)-2-[(2R,3R)-3-(hydroxymethyl)-2-methylpiperidin-1-yl]-2-phenylethanol has a molecular weight of 249.35 g/mol, XLogP of 1.81, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(2R,3R)-3-(hydroxymethyl)-2-methylpiperidin-1-yl]-2-phenylethanol is sourced from PubChem (CID 143702380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).