(3S,4R)-4-aminooxolan-3-ol

C4H9NO2 — CID 11768516

IUPAC(3S,4R)-4-aminooxolan-3-ol
SMILESN[C@@H]1COC[C@H]1O
InChIInChI=1S/C4H9NO2/c5-3-1-7-2-4(3)6/h3-4,6H,1-2,5H2/t3-,4-/m1/s1
InChIKeyHQVKXDYSIGDGSY-QWWZWVQMSA-N
MW103.12 g/mol
LogP-1.30
Rot. Bonds

About (3S,4R)-4-aminooxolan-3-ol

(3S,4R)-4-aminooxolan-3-ol (PubChem CID 11768516) has the molecular formula C4H9NO2 and a molecular weight of 103.12 g/mol. Its IUPAC name is (3S,4R)-4-aminooxolan-3-ol.

Molecular Properties

Compound Name(3S,4R)-4-aminooxolan-3-ol
PubChem CID11768516
Molecular FormulaC4H9NO2
Molecular Weight103.12 g/mol
Exact Mass103.06
IUPAC Name(3S,4R)-4-aminooxolan-3-ol
SMILESN[C@@H]1COC[C@H]1O
InChIInChI=1S/C4H9NO2/c5-3-1-7-2-4(3)6/h3-4,6H,1-2,5H2/t3-,4-/m1/s1
InChIKeyHQVKXDYSIGDGSY-QWWZWVQMSA-N
XLogP-1.30
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.12
LogP ≤ 5-1.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (3S,4R)-4-aminooxolan-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

Frequently Asked Questions

What is the IUPAC name of (3S,4R)-4-aminooxolan-3-ol?
The IUPAC name of (3S,4R)-4-aminooxolan-3-ol (CID 11768516) is (3S,4R)-4-aminooxolan-3-ol.
What is the SMILES notation for (3S,4R)-4-aminooxolan-3-ol?
The canonical SMILES for (3S,4R)-4-aminooxolan-3-ol is N[C@@H]1COC[C@H]1O.
What is the InChIKey of (3S,4R)-4-aminooxolan-3-ol?
The InChIKey is HQVKXDYSIGDGSY-QWWZWVQMSA-N. The full InChI is InChI=1S/C4H9NO2/c5-3-1-7-2-4(3)6/h3-4,6H,1-2,5H2/t3-,4-/m1/s1.
What are the key properties of (3S,4R)-4-aminooxolan-3-ol?
(3S,4R)-4-aminooxolan-3-ol has a molecular weight of 103.12 g/mol, XLogP of -1.30, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S,4R)-4-aminooxolan-3-ol is sourced from PubChem (CID 11768516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).