(2S,3R,4R,5R,6R)-5-fluoro-4,6-dimethoxy-2-methyloxan-3-ol

C8H15FO4 — CID 130757739

IUPAC(2S,3R,4R,5R,6R)-5-fluoro-4,6-dimethoxy-2-methyloxan-3-ol
SMILESCO[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](OC)[C@H]1F
InChIInChI=1S/C8H15FO4/c1-4-6(10)7(11-2)5(9)8(12-3)13-4/h4-8,10H,1-3H3/t4-,5+,6+,7-,8+/m0/s1
InChIKeyARYCRWDLGUQTRH-FMGWEMOISA-N
MW194.20 g/mol
LogP0.09
Rot. Bonds2

About (2S,3R,4R,5R,6R)-5-fluoro-4,6-dimethoxy-2-methyloxan-3-ol

(2S,3R,4R,5R,6R)-5-fluoro-4,6-dimethoxy-2-methyloxan-3-ol (PubChem CID 130757739) has the molecular formula C8H15FO4 and a molecular weight of 194.20 g/mol. Its IUPAC name is (2S,3R,4R,5R,6R)-5-fluoro-4,6-dimethoxy-2-methyloxan-3-ol.

Molecular Properties

Compound Name(2S,3R,4R,5R,6R)-5-fluoro-4,6-dimethoxy-2-methyloxan-3-ol
PubChem CID130757739
Molecular FormulaC8H15FO4
Molecular Weight194.20 g/mol
Exact Mass194.10
IUPAC Name(2S,3R,4R,5R,6R)-5-fluoro-4,6-dimethoxy-2-methyloxan-3-ol
SMILESCO[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](OC)[C@H]1F
InChIInChI=1S/C8H15FO4/c1-4-6(10)7(11-2)5(9)8(12-3)13-4/h4-8,10H,1-3H3/t4-,5+,6+,7-,8+/m0/s1
InChIKeyARYCRWDLGUQTRH-FMGWEMOISA-N
XLogP0.09
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.20
LogP ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2S,3R,4R,5R,6R)-5-fluoro-4,6-dimethoxy-2-methyloxan-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,3R,4S,5R,6S)-4,5,6-trimethoxy-2-methyloxan-3-ol
CID 13122553
(2R,5S)-4-methoxy-2,6-dimethyloxane-3,5-diol
CID 157162950
(2R,3R,5S)-2-methoxy-6-methyloxane-3,4,5-triol
CID 155602482
(3S,4R,5S,6S)-4,5-dimethoxy-2,6-dimethyloxan-3-ol
CID 129044484
(2S,3R,4R,5S,6R)-2-methoxy-6-methyloxane-3,4,5-triol
CID 12904923
(2R,5R)-2-methoxy-6-methyloxane-3,4,5-triol
CID 59892948
(3R,4S,5S,6R)-4-methoxy-6-methyloxane-2,3,5-triol
CID 15558282
(2S,3R,4R,5S,6S)-6-methoxy-2,5-dimethyloxane-3,4-diol
CID 130891159
(2S,3R,4S,5R,6R)-3,4-dimethoxy-6-methyloxane-2,5-diol
CID 130928120
(2S,3R,4R,5R,6S)-2-[(2R,3R,4R,5S,6S)-5-hydroxy-2-methoxy-6-methyl-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-4-yl]oxy-6-methyloxane-3,4,5-triol
CID 139084048
(2S,3R,4S,5S,6S)-2-[(2R,3R,4S,5S,6S)-5-hydroxy-2,3-dimethoxy-6-methyloxan-4-yl]oxy-6-methyl-4-[(2R,3S,4S,5S,6R)-3,4,5-trimethoxy-6-methyloxan-2-yl]oxyoxane-3,5-diol
CID 162842808
(2R,3S,5S)-4-fluoro-3-methoxy-2-(methoxymethyl)-5-methyloxolane;(2S,4R,5R)-4-methoxy-5-(methoxymethyl)-2-methyloxolan-3-ol
CID 158901360

Frequently Asked Questions

What is the IUPAC name of (2S,3R,4R,5R,6R)-5-fluoro-4,6-dimethoxy-2-methyloxan-3-ol?
The IUPAC name of (2S,3R,4R,5R,6R)-5-fluoro-4,6-dimethoxy-2-methyloxan-3-ol (CID 130757739) is (2S,3R,4R,5R,6R)-5-fluoro-4,6-dimethoxy-2-methyloxan-3-ol.
What is the SMILES notation for (2S,3R,4R,5R,6R)-5-fluoro-4,6-dimethoxy-2-methyloxan-3-ol?
The canonical SMILES for (2S,3R,4R,5R,6R)-5-fluoro-4,6-dimethoxy-2-methyloxan-3-ol is CO[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](OC)[C@H]1F.
What is the InChIKey of (2S,3R,4R,5R,6R)-5-fluoro-4,6-dimethoxy-2-methyloxan-3-ol?
The InChIKey is ARYCRWDLGUQTRH-FMGWEMOISA-N. The full InChI is InChI=1S/C8H15FO4/c1-4-6(10)7(11-2)5(9)8(12-3)13-4/h4-8,10H,1-3H3/t4-,5+,6+,7-,8+/m0/s1.
What are the key properties of (2S,3R,4R,5R,6R)-5-fluoro-4,6-dimethoxy-2-methyloxan-3-ol?
(2S,3R,4R,5R,6R)-5-fluoro-4,6-dimethoxy-2-methyloxan-3-ol has a molecular weight of 194.20 g/mol, XLogP of 0.09, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3R,4R,5R,6R)-5-fluoro-4,6-dimethoxy-2-methyloxan-3-ol is sourced from PubChem (CID 130757739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).