(1R,2S,3R,4R)-1-(3-methyloxolan-2-yl)pentane-1,2,3,4,5-pentol

C10H20O6 — CID 54059741

IUPAC(1R,2S,3R,4R)-1-(3-methyloxolan-2-yl)pentane-1,2,3,4,5-pentol
SMILESCC1CCOC1[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO
InChIInChI=1S/C10H20O6/c1-5-2-3-16-10(5)9(15)8(14)7(13)6(12)4-11/h5-15H,2-4H2,1H3/t5?,6-,7-,8+,9-,10?/m1/s1
InChIKeyLYVBMRYTQNOAPE-VXIHOVOASA-N
MW236.26 g/mol
LogP-2.15
Rot. Bonds5

About (1R,2S,3R,4R)-1-(3-methyloxolan-2-yl)pentane-1,2,3,4,5-pentol

(1R,2S,3R,4R)-1-(3-methyloxolan-2-yl)pentane-1,2,3,4,5-pentol (PubChem CID 54059741) has the molecular formula C10H20O6 and a molecular weight of 236.26 g/mol. Its IUPAC name is (1R,2S,3R,4R)-1-(3-methyloxolan-2-yl)pentane-1,2,3,4,5-pentol.

Molecular Properties

Compound Name(1R,2S,3R,4R)-1-(3-methyloxolan-2-yl)pentane-1,2,3,4,5-pentol
PubChem CID54059741
Molecular FormulaC10H20O6
Molecular Weight236.26 g/mol
Exact Mass236.13
IUPAC Name(1R,2S,3R,4R)-1-(3-methyloxolan-2-yl)pentane-1,2,3,4,5-pentol
SMILESCC1CCOC1[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO
InChIInChI=1S/C10H20O6/c1-5-2-3-16-10(5)9(15)8(14)7(13)6(12)4-11/h5-15H,2-4H2,1H3/t5?,6-,7-,8+,9-,10?/m1/s1
InChIKeyLYVBMRYTQNOAPE-VXIHOVOASA-N
XLogP-2.15
TPSA110.38 Ų
H-Bond Donors5
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.26
LogP ≤ 5-2.15
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (1R,2S,3R,4R)-1-(3-methyloxolan-2-yl)pentane-1,2,3,4,5-pentol?
The IUPAC name of (1R,2S,3R,4R)-1-(3-methyloxolan-2-yl)pentane-1,2,3,4,5-pentol (CID 54059741) is (1R,2S,3R,4R)-1-(3-methyloxolan-2-yl)pentane-1,2,3,4,5-pentol.
What is the SMILES notation for (1R,2S,3R,4R)-1-(3-methyloxolan-2-yl)pentane-1,2,3,4,5-pentol?
The canonical SMILES for (1R,2S,3R,4R)-1-(3-methyloxolan-2-yl)pentane-1,2,3,4,5-pentol is CC1CCOC1[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.
What is the InChIKey of (1R,2S,3R,4R)-1-(3-methyloxolan-2-yl)pentane-1,2,3,4,5-pentol?
The InChIKey is LYVBMRYTQNOAPE-VXIHOVOASA-N. The full InChI is InChI=1S/C10H20O6/c1-5-2-3-16-10(5)9(15)8(14)7(13)6(12)4-11/h5-15H,2-4H2,1H3/t5?,6-,7-,8+,9-,10?/m1/s1.
What are the key properties of (1R,2S,3R,4R)-1-(3-methyloxolan-2-yl)pentane-1,2,3,4,5-pentol?
(1R,2S,3R,4R)-1-(3-methyloxolan-2-yl)pentane-1,2,3,4,5-pentol has a molecular weight of 236.26 g/mol, XLogP of -2.15, 5 rotatable bonds, 5 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,2S,3R,4R)-1-(3-methyloxolan-2-yl)pentane-1,2,3,4,5-pentol is sourced from PubChem (CID 54059741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).