4-[3-(4-oxo-1,3-oxazolidin-3-yl)butyl]morpholin-3-one

C11H18N2O4 — CID 18374166

IUPAC4-[3-(4-oxo-1,3-oxazolidin-3-yl)butyl]morpholin-3-one
SMILESCC(CCN1CCOCC1=O)N1COCC1=O
InChIInChI=1S/C11H18N2O4/c1-9(13-8-17-7-11(13)15)2-3-12-4-5-16-6-10(12)14/h9H,2-8H2,1H3
InChIKeyLDMJHJQVUCMDMP-UHFFFAOYSA-N
MW242.27 g/mol
LogP-0.56
Rot. Bonds4

About 4-[3-(4-oxo-1,3-oxazolidin-3-yl)butyl]morpholin-3-one

4-[3-(4-oxo-1,3-oxazolidin-3-yl)butyl]morpholin-3-one (PubChem CID 18374166) has the molecular formula C11H18N2O4 and a molecular weight of 242.27 g/mol. Its IUPAC name is 4-[3-(4-oxo-1,3-oxazolidin-3-yl)butyl]morpholin-3-one.

Molecular Properties

Compound Name4-[3-(4-oxo-1,3-oxazolidin-3-yl)butyl]morpholin-3-one
PubChem CID18374166
Molecular FormulaC11H18N2O4
Molecular Weight242.27 g/mol
Exact Mass242.13
IUPAC Name4-[3-(4-oxo-1,3-oxazolidin-3-yl)butyl]morpholin-3-one
SMILESCC(CCN1CCOCC1=O)N1COCC1=O
InChIInChI=1S/C11H18N2O4/c1-9(13-8-17-7-11(13)15)2-3-12-4-5-16-6-10(12)14/h9H,2-8H2,1H3
InChIKeyLDMJHJQVUCMDMP-UHFFFAOYSA-N
XLogP-0.56
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.27
LogP ≤ 5-0.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[3-(4-oxo-1,3-oxazolidin-3-yl)butyl]morpholin-3-one?
The IUPAC name of 4-[3-(4-oxo-1,3-oxazolidin-3-yl)butyl]morpholin-3-one (CID 18374166) is 4-[3-(4-oxo-1,3-oxazolidin-3-yl)butyl]morpholin-3-one.
What is the SMILES notation for 4-[3-(4-oxo-1,3-oxazolidin-3-yl)butyl]morpholin-3-one?
The canonical SMILES for 4-[3-(4-oxo-1,3-oxazolidin-3-yl)butyl]morpholin-3-one is CC(CCN1CCOCC1=O)N1COCC1=O.
What is the InChIKey of 4-[3-(4-oxo-1,3-oxazolidin-3-yl)butyl]morpholin-3-one?
The InChIKey is LDMJHJQVUCMDMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O4/c1-9(13-8-17-7-11(13)15)2-3-12-4-5-16-6-10(12)14/h9H,2-8H2,1H3.
What are the key properties of 4-[3-(4-oxo-1,3-oxazolidin-3-yl)butyl]morpholin-3-one?
4-[3-(4-oxo-1,3-oxazolidin-3-yl)butyl]morpholin-3-one has a molecular weight of 242.27 g/mol, XLogP of -0.56, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(4-oxo-1,3-oxazolidin-3-yl)butyl]morpholin-3-one is sourced from PubChem (CID 18374166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).