methyl (2R)-2-[(2R,3S,5R)-5-methyl-3-phenyloxolan-2-yl]propanoate

C15H20O3 — CID 134900360

IUPACmethyl (2R)-2-[(2R,3S,5R)-5-methyl-3-phenyloxolan-2-yl]propanoate
SMILESCOC(=O)[C@H](C)[C@@H]1O[C@H](C)C[C@H]1c1ccccc1
InChIInChI=1S/C15H20O3/c1-10-9-13(12-7-5-4-6-8-12)14(18-10)11(2)15(16)17-3/h4-8,10-11,13-14H,9H2,1-3H3/t10-,11-,13+,14+/m1/s1
InChIKeyOQFSLCYWWZAEAC-RFHZTLPTSA-N
MW248.32 g/mol
LogP2.76
Rot. Bonds3

About methyl (2R)-2-[(2R,3S,5R)-5-methyl-3-phenyloxolan-2-yl]propanoate

methyl (2R)-2-[(2R,3S,5R)-5-methyl-3-phenyloxolan-2-yl]propanoate (PubChem CID 134900360) has the molecular formula C15H20O3 and a molecular weight of 248.32 g/mol. Its IUPAC name is methyl (2R)-2-[(2R,3S,5R)-5-methyl-3-phenyloxolan-2-yl]propanoate.

Molecular Properties

Compound Namemethyl (2R)-2-[(2R,3S,5R)-5-methyl-3-phenyloxolan-2-yl]propanoate
PubChem CID134900360
Molecular FormulaC15H20O3
Molecular Weight248.32 g/mol
Exact Mass248.14
IUPAC Namemethyl (2R)-2-[(2R,3S,5R)-5-methyl-3-phenyloxolan-2-yl]propanoate
SMILESCOC(=O)[C@H](C)[C@@H]1O[C@H](C)C[C@H]1c1ccccc1
InChIInChI=1S/C15H20O3/c1-10-9-13(12-7-5-4-6-8-12)14(18-10)11(2)15(16)17-3/h4-8,10-11,13-14H,9H2,1-3H3/t10-,11-,13+,14+/m1/s1
InChIKeyOQFSLCYWWZAEAC-RFHZTLPTSA-N
XLogP2.76
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.32
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze methyl (2R)-2-[(2R,3S,5R)-5-methyl-3-phenyloxolan-2-yl]propanoate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of methyl (2R)-2-[(2R,3S,5R)-5-methyl-3-phenyloxolan-2-yl]propanoate?
The IUPAC name of methyl (2R)-2-[(2R,3S,5R)-5-methyl-3-phenyloxolan-2-yl]propanoate (CID 134900360) is methyl (2R)-2-[(2R,3S,5R)-5-methyl-3-phenyloxolan-2-yl]propanoate.
What is the SMILES notation for methyl (2R)-2-[(2R,3S,5R)-5-methyl-3-phenyloxolan-2-yl]propanoate?
The canonical SMILES for methyl (2R)-2-[(2R,3S,5R)-5-methyl-3-phenyloxolan-2-yl]propanoate is COC(=O)[C@H](C)[C@@H]1O[C@H](C)C[C@H]1c1ccccc1.
What is the InChIKey of methyl (2R)-2-[(2R,3S,5R)-5-methyl-3-phenyloxolan-2-yl]propanoate?
The InChIKey is OQFSLCYWWZAEAC-RFHZTLPTSA-N. The full InChI is InChI=1S/C15H20O3/c1-10-9-13(12-7-5-4-6-8-12)14(18-10)11(2)15(16)17-3/h4-8,10-11,13-14H,9H2,1-3H3/t10-,11-,13+,14+/m1/s1.
What are the key properties of methyl (2R)-2-[(2R,3S,5R)-5-methyl-3-phenyloxolan-2-yl]propanoate?
methyl (2R)-2-[(2R,3S,5R)-5-methyl-3-phenyloxolan-2-yl]propanoate has a molecular weight of 248.32 g/mol, XLogP of 2.76, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl (2R)-2-[(2R,3S,5R)-5-methyl-3-phenyloxolan-2-yl]propanoate is sourced from PubChem (CID 134900360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).