3-(1-hydroxyethyl)morpholin-2-one

C6H11NO3 — CID 22379807

IUPAC3-(1-hydroxyethyl)morpholin-2-one
SMILESCC(O)C1NCCOC1=O
InChIInChI=1S/C6H11NO3/c1-4(8)5-6(9)10-3-2-7-5/h4-5,7-8H,2-3H2,1H3
InChIKeyCVBSSRMTQFVWIQ-UHFFFAOYSA-N
MW145.16 g/mol
LogP-1.12
Rot. Bonds1

About 3-(1-hydroxyethyl)morpholin-2-one

3-(1-hydroxyethyl)morpholin-2-one (PubChem CID 22379807) has the molecular formula C6H11NO3 and a molecular weight of 145.16 g/mol. Its IUPAC name is 3-(1-hydroxyethyl)morpholin-2-one.

Molecular Properties

Compound Name3-(1-hydroxyethyl)morpholin-2-one
PubChem CID22379807
Molecular FormulaC6H11NO3
Molecular Weight145.16 g/mol
Exact Mass145.07
IUPAC Name3-(1-hydroxyethyl)morpholin-2-one
SMILESCC(O)C1NCCOC1=O
InChIInChI=1S/C6H11NO3/c1-4(8)5-6(9)10-3-2-7-5/h4-5,7-8H,2-3H2,1H3
InChIKeyCVBSSRMTQFVWIQ-UHFFFAOYSA-N
XLogP-1.12
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.16
LogP ≤ 5-1.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(1-hydroxyethyl)morpholin-2-one?
The IUPAC name of 3-(1-hydroxyethyl)morpholin-2-one (CID 22379807) is 3-(1-hydroxyethyl)morpholin-2-one.
What is the SMILES notation for 3-(1-hydroxyethyl)morpholin-2-one?
The canonical SMILES for 3-(1-hydroxyethyl)morpholin-2-one is CC(O)C1NCCOC1=O.
What is the InChIKey of 3-(1-hydroxyethyl)morpholin-2-one?
The InChIKey is CVBSSRMTQFVWIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO3/c1-4(8)5-6(9)10-3-2-7-5/h4-5,7-8H,2-3H2,1H3.
What are the key properties of 3-(1-hydroxyethyl)morpholin-2-one?
3-(1-hydroxyethyl)morpholin-2-one has a molecular weight of 145.16 g/mol, XLogP of -1.12, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-hydroxyethyl)morpholin-2-one is sourced from PubChem (CID 22379807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).