[(3R)-1-[(2S)-2-phenylpropyl]piperidin-3-yl]methanol

C15H23NO — CID 129425520

IUPAC[(3R)-1-[(2S)-2-phenylpropyl]piperidin-3-yl]methanol
SMILESC[C@H](CN1CCC[C@@H](CO)C1)c1ccccc1
InChIInChI=1S/C15H23NO/c1-13(15-7-3-2-4-8-15)10-16-9-5-6-14(11-16)12-17/h2-4,7-8,13-14,17H,5-6,9-12H2,1H3/t13-,14-/m1/s1
InChIKeyUMBGFRZHJICNLX-ZIAGYGMSSA-N
MW233.36 g/mol
LogP2.49
Rot. Bonds4

About [(3R)-1-[(2S)-2-phenylpropyl]piperidin-3-yl]methanol

[(3R)-1-[(2S)-2-phenylpropyl]piperidin-3-yl]methanol (PubChem CID 129425520) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is [(3R)-1-[(2S)-2-phenylpropyl]piperidin-3-yl]methanol.

Molecular Properties

Compound Name[(3R)-1-[(2S)-2-phenylpropyl]piperidin-3-yl]methanol
PubChem CID129425520
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name[(3R)-1-[(2S)-2-phenylpropyl]piperidin-3-yl]methanol
SMILESC[C@H](CN1CCC[C@@H](CO)C1)c1ccccc1
InChIInChI=1S/C15H23NO/c1-13(15-7-3-2-4-8-15)10-16-9-5-6-14(11-16)12-17/h2-4,7-8,13-14,17H,5-6,9-12H2,1H3/t13-,14-/m1/s1
InChIKeyUMBGFRZHJICNLX-ZIAGYGMSSA-N
XLogP2.49
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[1-(2-phenylpropyl)piperidin-3-yl]methyl]propan-2-amine
CID 63240509
N-methyl-1-(2-phenylpropyl)piperidin-3-amine
CID 55086340
methyl 3-[3-(hydroxymethyl)piperidin-1-yl]-2-phenylpropanoate
CID 64564821
N-phenyl-N-[[(3R)-1-(2-phenylpropyl)piperidin-3-yl]methyl]propanamide
CID 59101556
N-[[1-(2-phenylpropyl)pyrrolidin-3-yl]methyl]ethanamine
CID 113430223
[1-(2-ethylbutyl)piperidin-3-yl]methanol
CID 82931010
1-(2-phenylpropyl)-3-pyrrolidin-2-ylpiperidine
CID 61101148
(3R)-1-[(2S)-2-phenylpropyl]pyrrolidine-3-carboxylic acid
CID 129413679
1-(2-phenylpropyl)azetidin-3-ol
CID 121200321
3-methyl-1-(2-phenylpropyl)piperidin-4-amine
CID 79879108
1-[(2S)-2-phenylpropyl]piperidine-3,4,5-triol
CID 157039058
1-[(2R)-2-phenylpropyl]piperidine-3,4,5-triol
CID 157039301

Frequently Asked Questions

What is the IUPAC name of [(3R)-1-[(2S)-2-phenylpropyl]piperidin-3-yl]methanol?
The IUPAC name of [(3R)-1-[(2S)-2-phenylpropyl]piperidin-3-yl]methanol (CID 129425520) is [(3R)-1-[(2S)-2-phenylpropyl]piperidin-3-yl]methanol.
What is the SMILES notation for [(3R)-1-[(2S)-2-phenylpropyl]piperidin-3-yl]methanol?
The canonical SMILES for [(3R)-1-[(2S)-2-phenylpropyl]piperidin-3-yl]methanol is C[C@H](CN1CCC[C@@H](CO)C1)c1ccccc1.
What is the InChIKey of [(3R)-1-[(2S)-2-phenylpropyl]piperidin-3-yl]methanol?
The InChIKey is UMBGFRZHJICNLX-ZIAGYGMSSA-N. The full InChI is InChI=1S/C15H23NO/c1-13(15-7-3-2-4-8-15)10-16-9-5-6-14(11-16)12-17/h2-4,7-8,13-14,17H,5-6,9-12H2,1H3/t13-,14-/m1/s1.
What are the key properties of [(3R)-1-[(2S)-2-phenylpropyl]piperidin-3-yl]methanol?
[(3R)-1-[(2S)-2-phenylpropyl]piperidin-3-yl]methanol has a molecular weight of 233.36 g/mol, XLogP of 2.49, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(3R)-1-[(2S)-2-phenylpropyl]piperidin-3-yl]methanol is sourced from PubChem (CID 129425520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).