6-(2-hydroxyethyl)-4-(2-hydroxyphenyl)morpholin-3-one

C12H15NO4 — CID 115067675

IUPAC6-(2-hydroxyethyl)-4-(2-hydroxyphenyl)morpholin-3-one
SMILESO=C1COC(CCO)CN1c1ccccc1O
InChIInChI=1S/C12H15NO4/c14-6-5-9-7-13(12(16)8-17-9)10-3-1-2-4-11(10)15/h1-4,9,14-15H,5-8H2
InChIKeyQBUPBQSSVGNWAU-UHFFFAOYSA-N
MW237.25 g/mol
LogP0.51
Rot. Bonds3

About 6-(2-hydroxyethyl)-4-(2-hydroxyphenyl)morpholin-3-one

6-(2-hydroxyethyl)-4-(2-hydroxyphenyl)morpholin-3-one (PubChem CID 115067675) has the molecular formula C12H15NO4 and a molecular weight of 237.25 g/mol. Its IUPAC name is 6-(2-hydroxyethyl)-4-(2-hydroxyphenyl)morpholin-3-one.

Molecular Properties

Compound Name6-(2-hydroxyethyl)-4-(2-hydroxyphenyl)morpholin-3-one
PubChem CID115067675
Molecular FormulaC12H15NO4
Molecular Weight237.25 g/mol
Exact Mass237.10
IUPAC Name6-(2-hydroxyethyl)-4-(2-hydroxyphenyl)morpholin-3-one
SMILESO=C1COC(CCO)CN1c1ccccc1O
InChIInChI=1S/C12H15NO4/c14-6-5-9-7-13(12(16)8-17-9)10-3-1-2-4-11(10)15/h1-4,9,14-15H,5-8H2
InChIKeyQBUPBQSSVGNWAU-UHFFFAOYSA-N
XLogP0.51
TPSA70.00 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.25
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-(hydroxymethyl)-4-(2-hydroxyphenyl)morpholin-3-one
CID 115067566
4-(2-chlorophenyl)-6-(3-hydroxypropyl)morpholin-3-one
CID 117008859
4-(2-bromophenyl)-6-(3-hydroxypropyl)morpholin-3-one
CID 117008868
5-(hydroxymethyl)-3-(2-hydroxyphenyl)-1,3-oxazolidin-2-one
CID 19773689
6-(aminomethyl)-4-[2-(trifluoromethyl)phenyl]morpholin-3-one
CID 115060288
2-[2-(aminomethyl)-5-oxomorpholin-4-yl]benzonitrile
CID 117008949
6-(3-aminopropyl)-4-(4-chlorophenyl)morpholin-3-one
CID 115060311
6-(aminomethyl)-4-naphthalen-2-ylmorpholin-3-one
CID 116838193
6-(3-aminopropyl)-4-(4-fluorophenyl)morpholin-3-one
CID 115060310
6-(2-hydroxyethyl)-4-(2-morpholin-4-ylethyl)morpholin-3-one
CID 117008890
1-(2-hydroxyphenyl)pyrrolidin-2-one
CID 695303
4-(4-bromo-3-methylphenyl)-6-(hydroxymethyl)morpholin-3-one
CID 117009003

Frequently Asked Questions

What is the IUPAC name of 6-(2-hydroxyethyl)-4-(2-hydroxyphenyl)morpholin-3-one?
The IUPAC name of 6-(2-hydroxyethyl)-4-(2-hydroxyphenyl)morpholin-3-one (CID 115067675) is 6-(2-hydroxyethyl)-4-(2-hydroxyphenyl)morpholin-3-one.
What is the SMILES notation for 6-(2-hydroxyethyl)-4-(2-hydroxyphenyl)morpholin-3-one?
The canonical SMILES for 6-(2-hydroxyethyl)-4-(2-hydroxyphenyl)morpholin-3-one is O=C1COC(CCO)CN1c1ccccc1O.
What is the InChIKey of 6-(2-hydroxyethyl)-4-(2-hydroxyphenyl)morpholin-3-one?
The InChIKey is QBUPBQSSVGNWAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO4/c14-6-5-9-7-13(12(16)8-17-9)10-3-1-2-4-11(10)15/h1-4,9,14-15H,5-8H2.
What are the key properties of 6-(2-hydroxyethyl)-4-(2-hydroxyphenyl)morpholin-3-one?
6-(2-hydroxyethyl)-4-(2-hydroxyphenyl)morpholin-3-one has a molecular weight of 237.25 g/mol, XLogP of 0.51, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-hydroxyethyl)-4-(2-hydroxyphenyl)morpholin-3-one is sourced from PubChem (CID 115067675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).