(2R)-4-phenyl-2-(phenylmethoxymethyl)-2,3-dihydropyran-6-one

C19H18O3 — CID 14667648

IUPAC(2R)-4-phenyl-2-(phenylmethoxymethyl)-2,3-dihydropyran-6-one
SMILESO=C1C=C(c2ccccc2)C[C@H](COCc2ccccc2)O1
InChIInChI=1S/C19H18O3/c20-19-12-17(16-9-5-2-6-10-16)11-18(22-19)14-21-13-15-7-3-1-4-8-15/h1-10,12,18H,11,13-14H2/t18-/m1/s1
InChIKeyIPIYCYNWSRSNMH-GOSISDBHSA-N
MW294.35 g/mol
LogP3.60
Rot. Bonds5

About (2R)-4-phenyl-2-(phenylmethoxymethyl)-2,3-dihydropyran-6-one

(2R)-4-phenyl-2-(phenylmethoxymethyl)-2,3-dihydropyran-6-one (PubChem CID 14667648) has the molecular formula C19H18O3 and a molecular weight of 294.35 g/mol. Its IUPAC name is (2R)-4-phenyl-2-(phenylmethoxymethyl)-2,3-dihydropyran-6-one.

Molecular Properties

Compound Name(2R)-4-phenyl-2-(phenylmethoxymethyl)-2,3-dihydropyran-6-one
PubChem CID14667648
Molecular FormulaC19H18O3
Molecular Weight294.35 g/mol
Exact Mass294.13
IUPAC Name(2R)-4-phenyl-2-(phenylmethoxymethyl)-2,3-dihydropyran-6-one
SMILESO=C1C=C(c2ccccc2)C[C@H](COCc2ccccc2)O1
InChIInChI=1S/C19H18O3/c20-19-12-17(16-9-5-2-6-10-16)11-18(22-19)14-21-13-15-7-3-1-4-8-15/h1-10,12,18H,11,13-14H2/t18-/m1/s1
InChIKeyIPIYCYNWSRSNMH-GOSISDBHSA-N
XLogP3.60
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(5S)-5-(phenylmethoxymethyl)oxolan-3-one
CID 168857190
7-(phenylmethoxymethyl)oxepan-2-one
CID 75080085
(5S)-3-phenyl-5-(phenylmethoxymethyl)-1,3-oxazolidin-2-one
CID 124582958
(4S,6R)-4-ethenyl-6-(phenylmethoxymethyl)oxan-2-one
CID 14667665
(3E)-3-[amino(phenyl)methylidene]-5-(phenylmethoxymethyl)oxolan-2-one
CID 102266195
(2R)-4-chloro-5-fluoro-2-(phenylmethoxymethyl)-2,3-dihydrofuran
CID 101027605
(3S,5S)-3-methyl-5-(phenylmethoxymethyl)oxolan-2-one
CID 10680435
3-(phenylmethoxymethyl)-2-oxabicyclo[4.1.0]heptan-5-one
CID 15893535
(6S)-3-hydroxy-6-(phenylmethoxymethyl)oxan-2-one
CID 67831333
(5S)-5-(phenylmethoxymethyl)-3-propan-2-yl-1,3-oxazolidin-2-one
CID 13339835
(2S,3R,3aR)-3-phenylmethoxy-2-(phenylmethoxymethyl)-3,3a-dihydro-2H-furo[3,2-b]furan-5-one
CID 10712966
3-(phenylmethoxymethyl)cyclobutan-1-one
CID 11819850

Frequently Asked Questions

What is the IUPAC name of (2R)-4-phenyl-2-(phenylmethoxymethyl)-2,3-dihydropyran-6-one?
The IUPAC name of (2R)-4-phenyl-2-(phenylmethoxymethyl)-2,3-dihydropyran-6-one (CID 14667648) is (2R)-4-phenyl-2-(phenylmethoxymethyl)-2,3-dihydropyran-6-one.
What is the SMILES notation for (2R)-4-phenyl-2-(phenylmethoxymethyl)-2,3-dihydropyran-6-one?
The canonical SMILES for (2R)-4-phenyl-2-(phenylmethoxymethyl)-2,3-dihydropyran-6-one is O=C1C=C(c2ccccc2)C[C@H](COCc2ccccc2)O1.
What is the InChIKey of (2R)-4-phenyl-2-(phenylmethoxymethyl)-2,3-dihydropyran-6-one?
The InChIKey is IPIYCYNWSRSNMH-GOSISDBHSA-N. The full InChI is InChI=1S/C19H18O3/c20-19-12-17(16-9-5-2-6-10-16)11-18(22-19)14-21-13-15-7-3-1-4-8-15/h1-10,12,18H,11,13-14H2/t18-/m1/s1.
What are the key properties of (2R)-4-phenyl-2-(phenylmethoxymethyl)-2,3-dihydropyran-6-one?
(2R)-4-phenyl-2-(phenylmethoxymethyl)-2,3-dihydropyran-6-one has a molecular weight of 294.35 g/mol, XLogP of 3.60, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-phenyl-2-(phenylmethoxymethyl)-2,3-dihydropyran-6-one is sourced from PubChem (CID 14667648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).