3-hydroxymorpholin-2-one

C4H7NO3 — CID 23063451

IUPAC3-hydroxymorpholin-2-one
SMILESO=C1OCCNC1O
InChIInChI=1S/C4H7NO3/c6-3-4(7)8-2-1-5-3/h3,5-6H,1-2H2
InChIKeyYFCBRDRFQNPCOB-UHFFFAOYSA-N
MW117.10 g/mol
LogP-1.55
Rot. Bonds

About 3-hydroxymorpholin-2-one

3-hydroxymorpholin-2-one (PubChem CID 23063451) has the molecular formula C4H7NO3 and a molecular weight of 117.10 g/mol. Its IUPAC name is 3-hydroxymorpholin-2-one.

Molecular Properties

Compound Name3-hydroxymorpholin-2-one
PubChem CID23063451
Molecular FormulaC4H7NO3
Molecular Weight117.10 g/mol
Exact Mass117.04
IUPAC Name3-hydroxymorpholin-2-one
SMILESO=C1OCCNC1O
InChIInChI=1S/C4H7NO3/c6-3-4(7)8-2-1-5-3/h3,5-6H,1-2H2
InChIKeyYFCBRDRFQNPCOB-UHFFFAOYSA-N
XLogP-1.55
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.10
LogP ≤ 5-1.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-hydroxymorpholin-2-one?
The IUPAC name of 3-hydroxymorpholin-2-one (CID 23063451) is 3-hydroxymorpholin-2-one.
What is the SMILES notation for 3-hydroxymorpholin-2-one?
The canonical SMILES for 3-hydroxymorpholin-2-one is O=C1OCCNC1O.
What is the InChIKey of 3-hydroxymorpholin-2-one?
The InChIKey is YFCBRDRFQNPCOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7NO3/c6-3-4(7)8-2-1-5-3/h3,5-6H,1-2H2.
What are the key properties of 3-hydroxymorpholin-2-one?
3-hydroxymorpholin-2-one has a molecular weight of 117.10 g/mol, XLogP of -1.55, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxymorpholin-2-one is sourced from PubChem (CID 23063451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).