(2R)-2-(2-phenylethyl)-2,3-dihydropyran-4-one

C13H14O2 — CID 11171675

IUPAC(2R)-2-(2-phenylethyl)-2,3-dihydropyran-4-one
SMILESO=C1C=CO[C@H](CCc2ccccc2)C1
InChIInChI=1S/C13H14O2/c14-12-8-9-15-13(10-12)7-6-11-4-2-1-3-5-11/h1-5,8-9,13H,6-7,10H2/t13-/m1/s1
InChIKeyRKVXYIFLNONBNH-CYBMUJFWSA-N
MW202.25 g/mol
LogP2.49
Rot. Bonds3

About (2R)-2-(2-phenylethyl)-2,3-dihydropyran-4-one

(2R)-2-(2-phenylethyl)-2,3-dihydropyran-4-one (PubChem CID 11171675) has the molecular formula C13H14O2 and a molecular weight of 202.25 g/mol. Its IUPAC name is (2R)-2-(2-phenylethyl)-2,3-dihydropyran-4-one.

Molecular Properties

Compound Name(2R)-2-(2-phenylethyl)-2,3-dihydropyran-4-one
PubChem CID11171675
Molecular FormulaC13H14O2
Molecular Weight202.25 g/mol
Exact Mass202.10
IUPAC Name(2R)-2-(2-phenylethyl)-2,3-dihydropyran-4-one
SMILESO=C1C=CO[C@H](CCc2ccccc2)C1
InChIInChI=1S/C13H14O2/c14-12-8-9-15-13(10-12)7-6-11-4-2-1-3-5-11/h1-5,8-9,13H,6-7,10H2/t13-/m1/s1
InChIKeyRKVXYIFLNONBNH-CYBMUJFWSA-N
XLogP2.49
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.25
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-phenylmethoxypropyl)-2,3-dihydropyran-4-one
CID 11075746
2-(2-cyclohexylethyl)-2,3-dihydropyran-4-one
CID 130785572
2-(isoindol-2-ylmethyl)-2,3-dihydropyran-4-one
CID 139908642
5-(2-phenylethyl)-4,5-dihydro-1,3-oxazole
CID 175040461
(2S,5S)-2,5-bis(2-phenylethyl)oxolane
CID 11108749
2-(2-phenylethyl)oxetane
CID 13354102
4-methoxy-5-methyl-2-(2-phenylethyl)-2,3-dihydropyran-6-one
CID 122677486
2-(2-phenylmethoxybutan-2-yl)-2,3-dihydropyran-4-one
CID 177460462
ethane;2-(2-phenylethyl)oxirane;propane
CID 90817072
(3R,4S)-1-benzyl-4-[(2R)-4-oxo-2,3-dihydropyran-2-yl]-3-phenylmethoxyazetidin-2-one
CID 100990405
(4aS,6R,9aR)-6-(2-phenylethyl)-2,3,4,4a,6,7,9,9a-octahydropyrano[3,2-b]oxepin-8-one
CID 101399234
2-(5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-heptadecafluorododecyl)-2,3-dihydropyran-4-one
CID 102600681

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2-phenylethyl)-2,3-dihydropyran-4-one?
The IUPAC name of (2R)-2-(2-phenylethyl)-2,3-dihydropyran-4-one (CID 11171675) is (2R)-2-(2-phenylethyl)-2,3-dihydropyran-4-one.
What is the SMILES notation for (2R)-2-(2-phenylethyl)-2,3-dihydropyran-4-one?
The canonical SMILES for (2R)-2-(2-phenylethyl)-2,3-dihydropyran-4-one is O=C1C=CO[C@H](CCc2ccccc2)C1.
What is the InChIKey of (2R)-2-(2-phenylethyl)-2,3-dihydropyran-4-one?
The InChIKey is RKVXYIFLNONBNH-CYBMUJFWSA-N. The full InChI is InChI=1S/C13H14O2/c14-12-8-9-15-13(10-12)7-6-11-4-2-1-3-5-11/h1-5,8-9,13H,6-7,10H2/t13-/m1/s1.
What are the key properties of (2R)-2-(2-phenylethyl)-2,3-dihydropyran-4-one?
(2R)-2-(2-phenylethyl)-2,3-dihydropyran-4-one has a molecular weight of 202.25 g/mol, XLogP of 2.49, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2-phenylethyl)-2,3-dihydropyran-4-one is sourced from PubChem (CID 11171675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).