4-morpholin-2-ylfuran-3-one

C8H11NO3 — CID 66866711

IUPAC4-morpholin-2-ylfuran-3-one
SMILESO=C1COC=C1C1CNCCO1
InChIInChI=1S/C8H11NO3/c10-7-5-11-4-6(7)8-3-9-1-2-12-8/h4,8-9H,1-3,5H2
InChIKeyACEQRBKHQNUHFQ-UHFFFAOYSA-N
MW169.18 g/mol
LogP-0.54
Rot. Bonds1

About 4-morpholin-2-ylfuran-3-one

4-morpholin-2-ylfuran-3-one (PubChem CID 66866711) has the molecular formula C8H11NO3 and a molecular weight of 169.18 g/mol. Its IUPAC name is 4-morpholin-2-ylfuran-3-one.

Molecular Properties

Compound Name4-morpholin-2-ylfuran-3-one
PubChem CID66866711
Molecular FormulaC8H11NO3
Molecular Weight169.18 g/mol
Exact Mass169.07
IUPAC Name4-morpholin-2-ylfuran-3-one
SMILESO=C1COC=C1C1CNCCO1
InChIInChI=1S/C8H11NO3/c10-7-5-11-4-6(7)8-3-9-1-2-12-8/h4,8-9H,1-3,5H2
InChIKeyACEQRBKHQNUHFQ-UHFFFAOYSA-N
XLogP-0.54
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.18
LogP ≤ 5-0.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-morpholin-2-ylfuran-3-one?
The IUPAC name of 4-morpholin-2-ylfuran-3-one (CID 66866711) is 4-morpholin-2-ylfuran-3-one.
What is the SMILES notation for 4-morpholin-2-ylfuran-3-one?
The canonical SMILES for 4-morpholin-2-ylfuran-3-one is O=C1COC=C1C1CNCCO1.
What is the InChIKey of 4-morpholin-2-ylfuran-3-one?
The InChIKey is ACEQRBKHQNUHFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO3/c10-7-5-11-4-6(7)8-3-9-1-2-12-8/h4,8-9H,1-3,5H2.
What are the key properties of 4-morpholin-2-ylfuran-3-one?
4-morpholin-2-ylfuran-3-one has a molecular weight of 169.18 g/mol, XLogP of -0.54, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-morpholin-2-ylfuran-3-one is sourced from PubChem (CID 66866711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).