(2R)-3-aminooxane-2,5-diol

C5H11NO3 — CID 143143228

IUPAC(2R)-3-aminooxane-2,5-diol
SMILESNC1CC(O)CO[C@H]1O
InChIInChI=1S/C5H11NO3/c6-4-1-3(7)2-9-5(4)8/h3-5,7-8H,1-2,6H2/t3?,4?,5-/m1/s1
InChIKeyQQEYFXOFAWQOQK-ZAGMFXPOSA-N
MW133.15 g/mol
LogP-1.59
Rot. Bonds

About (2R)-3-aminooxane-2,5-diol

(2R)-3-aminooxane-2,5-diol (PubChem CID 143143228) has the molecular formula C5H11NO3 and a molecular weight of 133.15 g/mol. Its IUPAC name is (2R)-3-aminooxane-2,5-diol.

Molecular Properties

Compound Name(2R)-3-aminooxane-2,5-diol
PubChem CID143143228
Molecular FormulaC5H11NO3
Molecular Weight133.15 g/mol
Exact Mass133.07
IUPAC Name(2R)-3-aminooxane-2,5-diol
SMILESNC1CC(O)CO[C@H]1O
InChIInChI=1S/C5H11NO3/c6-4-1-3(7)2-9-5(4)8/h3-5,7-8H,1-2,6H2/t3?,4?,5-/m1/s1
InChIKeyQQEYFXOFAWQOQK-ZAGMFXPOSA-N
XLogP-1.59
TPSA75.71 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.15
LogP ≤ 5-1.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-3-aminooxane-2,5-diol?
The IUPAC name of (2R)-3-aminooxane-2,5-diol (CID 143143228) is (2R)-3-aminooxane-2,5-diol.
What is the SMILES notation for (2R)-3-aminooxane-2,5-diol?
The canonical SMILES for (2R)-3-aminooxane-2,5-diol is NC1CC(O)CO[C@H]1O.
What is the InChIKey of (2R)-3-aminooxane-2,5-diol?
The InChIKey is QQEYFXOFAWQOQK-ZAGMFXPOSA-N. The full InChI is InChI=1S/C5H11NO3/c6-4-1-3(7)2-9-5(4)8/h3-5,7-8H,1-2,6H2/t3?,4?,5-/m1/s1.
What are the key properties of (2R)-3-aminooxane-2,5-diol?
(2R)-3-aminooxane-2,5-diol has a molecular weight of 133.15 g/mol, XLogP of -1.59, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-3-aminooxane-2,5-diol is sourced from PubChem (CID 143143228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).