4-(furan-2-ylmethyl)-2-(2-hydroxyethyl)morpholin-3-one

C11H15NO4 — CID 117008372

IUPAC4-(furan-2-ylmethyl)-2-(2-hydroxyethyl)morpholin-3-one
SMILESO=C1C(CCO)OCCN1Cc1ccco1
InChIInChI=1S/C11H15NO4/c13-5-3-10-11(14)12(4-7-16-10)8-9-2-1-6-15-9/h1-2,6,10,13H,3-5,7-8H2
InChIKeyATFNUJDVDMESPM-UHFFFAOYSA-N
MW225.24 g/mol
LogP0.39
Rot. Bonds4

About 4-(furan-2-ylmethyl)-2-(2-hydroxyethyl)morpholin-3-one

4-(furan-2-ylmethyl)-2-(2-hydroxyethyl)morpholin-3-one (PubChem CID 117008372) has the molecular formula C11H15NO4 and a molecular weight of 225.24 g/mol. Its IUPAC name is 4-(furan-2-ylmethyl)-2-(2-hydroxyethyl)morpholin-3-one.

Molecular Properties

Compound Name4-(furan-2-ylmethyl)-2-(2-hydroxyethyl)morpholin-3-one
PubChem CID117008372
Molecular FormulaC11H15NO4
Molecular Weight225.24 g/mol
Exact Mass225.10
IUPAC Name4-(furan-2-ylmethyl)-2-(2-hydroxyethyl)morpholin-3-one
SMILESO=C1C(CCO)OCCN1Cc1ccco1
InChIInChI=1S/C11H15NO4/c13-5-3-10-11(14)12(4-7-16-10)8-9-2-1-6-15-9/h1-2,6,10,13H,3-5,7-8H2
InChIKeyATFNUJDVDMESPM-UHFFFAOYSA-N
XLogP0.39
TPSA62.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.24
LogP ≤ 50.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[3-(furan-2-ylmethyl)-2-oxo-1,3-oxazinan-6-yl]propanoic acid
CID 117011105
(4S)-4-[(4aR,7aS)-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazine-4-carbonyl]-1-(furan-2-ylmethyl)pyrrolidin-2-one
CID 100909787
3-ethyl-1-(furan-2-ylmethyl)-1,4-diazepane-2,5-dione
CID 64957599
(2S)-4-(furan-2-ylmethyl)morpholine-2-carboxylic acid
CID 51441031
chlorobenzene;4-(cyclopropylmethyl)-2-(3-hydroxypropyl)morpholin-3-one
CID 144688123
1-(furan-2-ylmethyl)-5-hydroxy-1,3-diazinan-2-one
CID 83698973
(1S,2S,6R,7S)-4-(furan-2-ylmethyl)-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
CID 20575713
1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carbonyl chloride
CID 50873925
1-(furan-2-ylmethyl)pyrrolidine-3,4-diol
CID 106671878
(3R,4S)-1-(furan-2-ylmethyl)pyrrolidine-3,4-diol
CID 79420188
5-(bromomethyl)-3-(furan-2-ylmethyl)-1,3-oxazolidin-2-one
CID 82380170
(3aR,4S,7R,7aR)-2-(furan-2-ylmethyl)-3a,4,5,6,7,7a-hexahydro-4,7-epoxyisoindole-1,3-dione
CID 27451087

Frequently Asked Questions

What is the IUPAC name of 4-(furan-2-ylmethyl)-2-(2-hydroxyethyl)morpholin-3-one?
The IUPAC name of 4-(furan-2-ylmethyl)-2-(2-hydroxyethyl)morpholin-3-one (CID 117008372) is 4-(furan-2-ylmethyl)-2-(2-hydroxyethyl)morpholin-3-one.
What is the SMILES notation for 4-(furan-2-ylmethyl)-2-(2-hydroxyethyl)morpholin-3-one?
The canonical SMILES for 4-(furan-2-ylmethyl)-2-(2-hydroxyethyl)morpholin-3-one is O=C1C(CCO)OCCN1Cc1ccco1.
What is the InChIKey of 4-(furan-2-ylmethyl)-2-(2-hydroxyethyl)morpholin-3-one?
The InChIKey is ATFNUJDVDMESPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO4/c13-5-3-10-11(14)12(4-7-16-10)8-9-2-1-6-15-9/h1-2,6,10,13H,3-5,7-8H2.
What are the key properties of 4-(furan-2-ylmethyl)-2-(2-hydroxyethyl)morpholin-3-one?
4-(furan-2-ylmethyl)-2-(2-hydroxyethyl)morpholin-3-one has a molecular weight of 225.24 g/mol, XLogP of 0.39, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(furan-2-ylmethyl)-2-(2-hydroxyethyl)morpholin-3-one is sourced from PubChem (CID 117008372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).