(2R,3aR,6aS)-2-methoxy-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-4,5-diol

C8H14O4 — CID 10511417

IUPAC(2R,3aR,6aS)-2-methoxy-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-4,5-diol
SMILESCO[C@H]1C[C@@H]2C(O)C(O)C[C@@H]2O1
InChIInChI=1S/C8H14O4/c1-11-7-2-4-6(12-7)3-5(9)8(4)10/h4-10H,2-3H2,1H3/t4-,5?,6-,7+,8?/m0/s1
InChIKeyMAMNBEUJXNFFSB-BRFCOKSNSA-N
MW174.20 g/mol
LogP-0.51
Rot. Bonds1

About (2R,3aR,6aS)-2-methoxy-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-4,5-diol

(2R,3aR,6aS)-2-methoxy-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-4,5-diol (PubChem CID 10511417) has the molecular formula C8H14O4 and a molecular weight of 174.20 g/mol. Its IUPAC name is (2R,3aR,6aS)-2-methoxy-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-4,5-diol.

Molecular Properties

Compound Name(2R,3aR,6aS)-2-methoxy-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-4,5-diol
PubChem CID10511417
Molecular FormulaC8H14O4
Molecular Weight174.20 g/mol
Exact Mass174.09
IUPAC Name(2R,3aR,6aS)-2-methoxy-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-4,5-diol
SMILESCO[C@H]1C[C@@H]2C(O)C(O)C[C@@H]2O1
InChIInChI=1S/C8H14O4/c1-11-7-2-4-6(12-7)3-5(9)8(4)10/h4-10H,2-3H2,1H3/t4-,5?,6-,7+,8?/m0/s1
InChIKeyMAMNBEUJXNFFSB-BRFCOKSNSA-N
XLogP-0.51
TPSA58.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 5-0.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (2R,3aR,6aS)-2-methoxy-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-4,5-diol with MolForge

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Related Compounds

(2S,3R,4S,6S)-6-methoxy-2-methyloxane-3,4-diol
CID 12775768
(2S,3R,5S)-2,5-dimethoxyoxolan-3-ol
CID 99988447
(3S,4S,6R)-2-(hydroxymethyl)-6-methoxyoxane-3,4-diol
CID 58863017
(3aS,4R,6R,6aS)-2-methoxy-4-methyl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-6-ol
CID 158856895
(2S,3S,5S)-2-ethyl-5-methoxyoxolan-3-ol
CID 158313772
6-methoxy-2,4-dimethyloxan-3-ol
CID 58831559
(1S,4S,5R,6S,7S,9R,11S)-9-methoxy-2,10-dioxatricyclo[5.3.1.04,11]undecane-4,5,6-triol
CID 162850473
(2R,3R,4S,6S)-3-amino-6-methoxy-2-methyloxan-4-ol
CID 130909200
(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-methoxy-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-4-carbaldehyde
CID 14015997
(2R,3R,5R)-5-methoxy-2-[(1R)-1-methoxyethyl]oxolan-3-ol
CID 15927279

Frequently Asked Questions

What is the IUPAC name of (2R,3aR,6aS)-2-methoxy-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-4,5-diol?
The IUPAC name of (2R,3aR,6aS)-2-methoxy-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-4,5-diol (CID 10511417) is (2R,3aR,6aS)-2-methoxy-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-4,5-diol.
What is the SMILES notation for (2R,3aR,6aS)-2-methoxy-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-4,5-diol?
The canonical SMILES for (2R,3aR,6aS)-2-methoxy-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-4,5-diol is CO[C@H]1C[C@@H]2C(O)C(O)C[C@@H]2O1.
What is the InChIKey of (2R,3aR,6aS)-2-methoxy-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-4,5-diol?
The InChIKey is MAMNBEUJXNFFSB-BRFCOKSNSA-N. The full InChI is InChI=1S/C8H14O4/c1-11-7-2-4-6(12-7)3-5(9)8(4)10/h4-10H,2-3H2,1H3/t4-,5?,6-,7+,8?/m0/s1.
What are the key properties of (2R,3aR,6aS)-2-methoxy-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-4,5-diol?
(2R,3aR,6aS)-2-methoxy-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-4,5-diol has a molecular weight of 174.20 g/mol, XLogP of -0.51, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3aR,6aS)-2-methoxy-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-4,5-diol is sourced from PubChem (CID 10511417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).