(2S,3S,5S)-2-ethyl-5-methoxyoxolan-3-ol

C7H14O3 — CID 158313772

IUPAC(2S,3S,5S)-2-ethyl-5-methoxyoxolan-3-ol
SMILESCC[C@@H]1O[C@H](OC)C[C@@H]1O
InChIInChI=1S/C7H14O3/c1-3-6-5(8)4-7(9-2)10-6/h5-8H,3-4H2,1-2H3/t5-,6-,7-/m0/s1
InChIKeyLVFBRZHCYCQHTJ-ACZMJKKPSA-N
MW146.19 g/mol
LogP0.52
Rot. Bonds2

About (2S,3S,5S)-2-ethyl-5-methoxyoxolan-3-ol

(2S,3S,5S)-2-ethyl-5-methoxyoxolan-3-ol (PubChem CID 158313772) has the molecular formula C7H14O3 and a molecular weight of 146.19 g/mol. Its IUPAC name is (2S,3S,5S)-2-ethyl-5-methoxyoxolan-3-ol.

Molecular Properties

Compound Name(2S,3S,5S)-2-ethyl-5-methoxyoxolan-3-ol
PubChem CID158313772
Molecular FormulaC7H14O3
Molecular Weight146.19 g/mol
Exact Mass146.09
IUPAC Name(2S,3S,5S)-2-ethyl-5-methoxyoxolan-3-ol
SMILESCC[C@@H]1O[C@H](OC)C[C@@H]1O
InChIInChI=1S/C7H14O3/c1-3-6-5(8)4-7(9-2)10-6/h5-8H,3-4H2,1-2H3/t5-,6-,7-/m0/s1
InChIKeyLVFBRZHCYCQHTJ-ACZMJKKPSA-N
XLogP0.52
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 50.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2S,3S,5S)-2-ethyl-5-methoxyoxolan-3-ol with MolForge

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

Launch Full Analysis

Related Compounds

(2R,3S,4R,6R)-2-ethyl-3,6-dimethoxyoxan-4-ol
CID 129234944
(2R,3S,5R)-5-methoxy-2-(methoxymethyl)oxolan-3-ol
CID 130763871
(2R,3S,5S)-5-methoxy-2-(methoxymethyl)oxolan-3-ol
CID 130763870
2-ethyl-6-methoxy-5-methyloxan-3-ol
CID 91204206
(3S,4S,6R)-2-(hydroxymethyl)-6-methoxyoxane-3,4-diol
CID 58863017
[(2R,3S,4R,6S)-4-hydroxy-2-(hydroxymethyl)-6-methoxyoxan-3-yl] hypoiodite
CID 142600377
(2R,3S)-2-ethyl-5-methyloxolan-3-ol
CID 174181244
(2S,5R)-2-ethyl-5-methyloxolan-3-ol;hydrate
CID 91272276
(2S,3R,5S)-2,5-dimethoxyoxolan-3-ol
CID 99988447
(2R,3S,4R,6S)-2-ethyl-4-(heptylamino)-6-methoxyoxan-3-ol
CID 101381510
(2R,3R,6R)-2-(hydroxymethyl)-6-methoxy-4-methyloxan-3-ol
CID 147159840
[(2S,3R,5R)-2-(hydroxymethyl)-5-methoxyoxolan-3-yl]methanol
CID 70296573

Frequently Asked Questions

What is the IUPAC name of (2S,3S,5S)-2-ethyl-5-methoxyoxolan-3-ol?
The IUPAC name of (2S,3S,5S)-2-ethyl-5-methoxyoxolan-3-ol (CID 158313772) is (2S,3S,5S)-2-ethyl-5-methoxyoxolan-3-ol.
What is the SMILES notation for (2S,3S,5S)-2-ethyl-5-methoxyoxolan-3-ol?
The canonical SMILES for (2S,3S,5S)-2-ethyl-5-methoxyoxolan-3-ol is CC[C@@H]1O[C@H](OC)C[C@@H]1O.
What is the InChIKey of (2S,3S,5S)-2-ethyl-5-methoxyoxolan-3-ol?
The InChIKey is LVFBRZHCYCQHTJ-ACZMJKKPSA-N. The full InChI is InChI=1S/C7H14O3/c1-3-6-5(8)4-7(9-2)10-6/h5-8H,3-4H2,1-2H3/t5-,6-,7-/m0/s1.
What are the key properties of (2S,3S,5S)-2-ethyl-5-methoxyoxolan-3-ol?
(2S,3S,5S)-2-ethyl-5-methoxyoxolan-3-ol has a molecular weight of 146.19 g/mol, XLogP of 0.52, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3S,5S)-2-ethyl-5-methoxyoxolan-3-ol is sourced from PubChem (CID 158313772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).