(2R)-2-(phenylmethoxymethyl)-3,6-dihydro-2H-pyran

C13H16O2 — CID 130750045

IUPAC(2R)-2-(phenylmethoxymethyl)-3,6-dihydro-2H-pyran
SMILESC1=CC[C@H](COCc2ccccc2)OC1
InChIInChI=1S/C13H16O2/c1-2-6-12(7-3-1)10-14-11-13-8-4-5-9-15-13/h1-7,13H,8-11H2/t13-/m1/s1
InChIKeyXMVPVSOSNSKJFH-CYBMUJFWSA-N
MW204.27 g/mol
LogP2.55
Rot. Bonds4

About (2R)-2-(phenylmethoxymethyl)-3,6-dihydro-2H-pyran

(2R)-2-(phenylmethoxymethyl)-3,6-dihydro-2H-pyran (PubChem CID 130750045) has the molecular formula C13H16O2 and a molecular weight of 204.27 g/mol. Its IUPAC name is (2R)-2-(phenylmethoxymethyl)-3,6-dihydro-2H-pyran.

Molecular Properties

Compound Name(2R)-2-(phenylmethoxymethyl)-3,6-dihydro-2H-pyran
PubChem CID130750045
Molecular FormulaC13H16O2
Molecular Weight204.27 g/mol
Exact Mass204.12
IUPAC Name(2R)-2-(phenylmethoxymethyl)-3,6-dihydro-2H-pyran
SMILESC1=CC[C@H](COCc2ccccc2)OC1
InChIInChI=1S/C13H16O2/c1-2-6-12(7-3-1)10-14-11-13-8-4-5-9-15-13/h1-7,13H,8-11H2/t13-/m1/s1
InChIKeyXMVPVSOSNSKJFH-CYBMUJFWSA-N
XLogP2.55
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(2S)-2-(phenylmethoxymethyl)-3,6-dihydro-2H-pyran
CID 46862703
(2R)-2-(phenylmethoxymethoxymethyl)oxirane
CID 129387534
oxolane;(2R)-2-(phenylmethoxymethyl)oxirane
CID 175076963
(5S)-5-(phenylmethoxymethyl)oxolan-3-one
CID 168857190
(2S,6S)-2,6-bis(phenylmethoxymethyl)morpholine
CID 176754636
(2R,4R)-4-bromo-2-(phenylmethoxymethyl)oxolane
CID 11086853
4,5-dimethyl-2-(phenylmethoxymethyl)-3,6-dihydro-2H-pyran
CID 154712027
2-(chloromethyl)oxirane;phenylmethanol;2-(phenylmethoxymethyl)oxirane
CID 163898082
(2R)-4-chloro-5-fluoro-2-(phenylmethoxymethyl)-2,3-dihydrofuran
CID 101027605
[4-(phenylmethoxymethyl)cyclohexyl]methoxymethylbenzene
CID 100982245
2-(phenylmethoxymethyl)-5-propan-2-ylmorpholine
CID 79246718
[4-(phenylmethoxymethyl)-1,3-dioxan-2-yl]methanol
CID 23452412

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(phenylmethoxymethyl)-3,6-dihydro-2H-pyran?
The IUPAC name of (2R)-2-(phenylmethoxymethyl)-3,6-dihydro-2H-pyran (CID 130750045) is (2R)-2-(phenylmethoxymethyl)-3,6-dihydro-2H-pyran.
What is the SMILES notation for (2R)-2-(phenylmethoxymethyl)-3,6-dihydro-2H-pyran?
The canonical SMILES for (2R)-2-(phenylmethoxymethyl)-3,6-dihydro-2H-pyran is C1=CC[C@H](COCc2ccccc2)OC1.
What is the InChIKey of (2R)-2-(phenylmethoxymethyl)-3,6-dihydro-2H-pyran?
The InChIKey is XMVPVSOSNSKJFH-CYBMUJFWSA-N. The full InChI is InChI=1S/C13H16O2/c1-2-6-12(7-3-1)10-14-11-13-8-4-5-9-15-13/h1-7,13H,8-11H2/t13-/m1/s1.
What are the key properties of (2R)-2-(phenylmethoxymethyl)-3,6-dihydro-2H-pyran?
(2R)-2-(phenylmethoxymethyl)-3,6-dihydro-2H-pyran has a molecular weight of 204.27 g/mol, XLogP of 2.55, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(phenylmethoxymethyl)-3,6-dihydro-2H-pyran is sourced from PubChem (CID 130750045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).