(2R)-2-(2-phenyl-1,3-dioxan-2-yl)piperidine

C15H21NO2 — CID 125497415

IUPAC(2R)-2-(2-phenyl-1,3-dioxan-2-yl)piperidine
SMILESc1ccc(C2([C@H]3CCCCN3)OCCCO2)cc1
InChIInChI=1S/C15H21NO2/c1-2-7-13(8-3-1)15(17-11-6-12-18-15)14-9-4-5-10-16-14/h1-3,7-8,14,16H,4-6,9-12H2/t14-/m1/s1
InChIKeyXESVVSFCBZYBHF-CQSZACIVSA-N
MW247.34 g/mol
LogP2.42
Rot. Bonds2

About (2R)-2-(2-phenyl-1,3-dioxan-2-yl)piperidine

(2R)-2-(2-phenyl-1,3-dioxan-2-yl)piperidine (PubChem CID 125497415) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is (2R)-2-(2-phenyl-1,3-dioxan-2-yl)piperidine.

Molecular Properties

Compound Name(2R)-2-(2-phenyl-1,3-dioxan-2-yl)piperidine
PubChem CID125497415
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC Name(2R)-2-(2-phenyl-1,3-dioxan-2-yl)piperidine
SMILESc1ccc(C2([C@H]3CCCCN3)OCCCO2)cc1
InChIInChI=1S/C15H21NO2/c1-2-7-13(8-3-1)15(17-11-6-12-18-15)14-9-4-5-10-16-14/h1-3,7-8,14,16H,4-6,9-12H2/t14-/m1/s1
InChIKeyXESVVSFCBZYBHF-CQSZACIVSA-N
XLogP2.42
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[5-(hydroxymethyl)-2-phenyl-2-[(2R)-piperidin-2-yl]-1,3-dioxan-5-yl]methanol
CID 125479548
4a-phenyl-2,3,4,5,6,7,8,8a-octahydro-1H-quinoline
CID 71741959
bis(2-phenyl-1,3-dioxan-2-yl)methanone
CID 175026730
2-[5-(2-methylphenyl)tetrazol-5-yl]piperidine
CID 90688343
(2S)-2-phenylpiperidine
CID 10997356
1-phenyl-2-oxabicyclo[4.1.0]heptane
CID 154332997
1-(2-cyclohexyl-2-phenyl-1,3-dioxan-5-yl)piperidine;hydrochloride
CID 3052092
3-(1-pyrrolidin-2-ylcyclohexyl)pyridine
CID 83911588
(1S,3S)-3-phenyl-1-[(2S)-piperidin-2-yl]-2,3-dihydroinden-1-ol
CID 92855941
2-phenyl-2-propan-2-yl-1,3-dioxane
CID 89439443
(2-phenyloxan-2-yl)silane
CID 123975784
2-(2-phenyl-2-thiophen-2-yl-1,3-dioxolan-4-yl)piperidine
CID 25079413

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2-phenyl-1,3-dioxan-2-yl)piperidine?
The IUPAC name of (2R)-2-(2-phenyl-1,3-dioxan-2-yl)piperidine (CID 125497415) is (2R)-2-(2-phenyl-1,3-dioxan-2-yl)piperidine.
What is the SMILES notation for (2R)-2-(2-phenyl-1,3-dioxan-2-yl)piperidine?
The canonical SMILES for (2R)-2-(2-phenyl-1,3-dioxan-2-yl)piperidine is c1ccc(C2([C@H]3CCCCN3)OCCCO2)cc1.
What is the InChIKey of (2R)-2-(2-phenyl-1,3-dioxan-2-yl)piperidine?
The InChIKey is XESVVSFCBZYBHF-CQSZACIVSA-N. The full InChI is InChI=1S/C15H21NO2/c1-2-7-13(8-3-1)15(17-11-6-12-18-15)14-9-4-5-10-16-14/h1-3,7-8,14,16H,4-6,9-12H2/t14-/m1/s1.
What are the key properties of (2R)-2-(2-phenyl-1,3-dioxan-2-yl)piperidine?
(2R)-2-(2-phenyl-1,3-dioxan-2-yl)piperidine has a molecular weight of 247.34 g/mol, XLogP of 2.42, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2-phenyl-1,3-dioxan-2-yl)piperidine is sourced from PubChem (CID 125497415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).