morpholine-2,3-diol

C4H9NO3 — CID 21225232

IUPACmorpholine-2,3-diol
SMILESOC1NCCOC1O
InChIInChI=1S/C4H9NO3/c6-3-4(7)8-2-1-5-3/h3-7H,1-2H2
InChIKeyGBPXQOLHLCTVOI-UHFFFAOYSA-N
MW119.12 g/mol
LogP-1.76
Rot. Bonds

About morpholine-2,3-diol

morpholine-2,3-diol (PubChem CID 21225232) has the molecular formula C4H9NO3 and a molecular weight of 119.12 g/mol. Its IUPAC name is morpholine-2,3-diol.

Molecular Properties

Compound Namemorpholine-2,3-diol
PubChem CID21225232
Molecular FormulaC4H9NO3
Molecular Weight119.12 g/mol
Exact Mass119.06
IUPAC Namemorpholine-2,3-diol
SMILESOC1NCCOC1O
InChIInChI=1S/C4H9NO3/c6-3-4(7)8-2-1-5-3/h3-7H,1-2H2
InChIKeyGBPXQOLHLCTVOI-UHFFFAOYSA-N
XLogP-1.76
TPSA61.72 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500119.12
LogP ≤ 5-1.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of morpholine-2,3-diol?
The IUPAC name of morpholine-2,3-diol (CID 21225232) is morpholine-2,3-diol.
What is the SMILES notation for morpholine-2,3-diol?
The canonical SMILES for morpholine-2,3-diol is OC1NCCOC1O.
What is the InChIKey of morpholine-2,3-diol?
The InChIKey is GBPXQOLHLCTVOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO3/c6-3-4(7)8-2-1-5-3/h3-7H,1-2H2.
What are the key properties of morpholine-2,3-diol?
morpholine-2,3-diol has a molecular weight of 119.12 g/mol, XLogP of -1.76, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for morpholine-2,3-diol is sourced from PubChem (CID 21225232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).