(2S,5S)-2-methyl-5-phenyloxolane

C11H14O — CID 71447018

IUPAC(2S,5S)-2-methyl-5-phenyloxolane
SMILESC[C@H]1CC[C@@H](c2ccccc2)O1
InChIInChI=1S/C11H14O/c1-9-7-8-11(12-9)10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3/t9-,11-/m0/s1
InChIKeyMAPLHIRYLFONGA-ONGXEEELSA-N
MW162.23 g/mol
LogP2.93
Rot. Bonds1

About (2S,5S)-2-methyl-5-phenyloxolane

(2S,5S)-2-methyl-5-phenyloxolane (PubChem CID 71447018) has the molecular formula C11H14O and a molecular weight of 162.23 g/mol. Its IUPAC name is (2S,5S)-2-methyl-5-phenyloxolane.

Molecular Properties

Compound Name(2S,5S)-2-methyl-5-phenyloxolane
PubChem CID71447018
Molecular FormulaC11H14O
Molecular Weight162.23 g/mol
Exact Mass162.10
IUPAC Name(2S,5S)-2-methyl-5-phenyloxolane
SMILESC[C@H]1CC[C@@H](c2ccccc2)O1
InChIInChI=1S/C11H14O/c1-9-7-8-11(12-9)10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3/t9-,11-/m0/s1
InChIKeyMAPLHIRYLFONGA-ONGXEEELSA-N
XLogP2.93
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.23
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2R,3R,6S)-6-methyl-2,3-diphenyloxane
CID 71654456
(2S,4S,6S)-2-methyl-6-phenyloxan-4-ol
CID 134981811
(2S)-2-methyl-6-phenyl-1,4-dioxane
CID 130461475
(2S,5R)-2-ethyl-5-phenyloxolane
CID 102280065
(2S,6S)-2-methyl-6-phenylmorpholine
CID 36689632
2-[(2R,5S)-5-phenyloxolan-2-yl]propan-2-ol
CID 11117220
(2S,5R)-2-(cycloprop-2-en-1-ylmethyl)-5-phenyloxolane
CID 156851355
(2S,5S)-2-(iodomethyl)-5-phenyloxolane
CID 101241677
(2S,5R)-2-(bromomethyl)-5-phenyloxolane
CID 23247977
(2R,4aS,8aR)-2-phenyl-3,4,4a,5,6,7,8,8a-octahydro-2H-chromene
CID 134961607
(2R,5R)-2-naphthalen-2-yl-5-phenyloxolane
CID 101344860
(2S,4S)-2-methyl-4-phenyl-1,3-dioxolane
CID 10374766

Frequently Asked Questions

What is the IUPAC name of (2S,5S)-2-methyl-5-phenyloxolane?
The IUPAC name of (2S,5S)-2-methyl-5-phenyloxolane (CID 71447018) is (2S,5S)-2-methyl-5-phenyloxolane.
What is the SMILES notation for (2S,5S)-2-methyl-5-phenyloxolane?
The canonical SMILES for (2S,5S)-2-methyl-5-phenyloxolane is C[C@H]1CC[C@@H](c2ccccc2)O1.
What is the InChIKey of (2S,5S)-2-methyl-5-phenyloxolane?
The InChIKey is MAPLHIRYLFONGA-ONGXEEELSA-N. The full InChI is InChI=1S/C11H14O/c1-9-7-8-11(12-9)10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3/t9-,11-/m0/s1.
What are the key properties of (2S,5S)-2-methyl-5-phenyloxolane?
(2S,5S)-2-methyl-5-phenyloxolane has a molecular weight of 162.23 g/mol, XLogP of 2.93, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,5S)-2-methyl-5-phenyloxolane is sourced from PubChem (CID 71447018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).