7-fluorospiro[1,4-dihydroquinoxaline-3,3'-oxolane]-2-one

C11H11FN2O2 — CID 79295412

IUPAC7-fluorospiro[1,4-dihydroquinoxaline-3,3'-oxolane]-2-one
SMILESO=C1Nc2cc(F)ccc2NC12CCOC2
InChIInChI=1S/C11H11FN2O2/c12-7-1-2-8-9(5-7)13-10(15)11(14-8)3-4-16-6-11/h1-2,5,14H,3-4,6H2,(H,13,15)
InChIKeyDWBAFEIARAWMLH-UHFFFAOYSA-N
MW222.22 g/mol
LogP1.35
Rot. Bonds

About 7-fluorospiro[1,4-dihydroquinoxaline-3,3'-oxolane]-2-one

7-fluorospiro[1,4-dihydroquinoxaline-3,3'-oxolane]-2-one (PubChem CID 79295412) has the molecular formula C11H11FN2O2 and a molecular weight of 222.22 g/mol. Its IUPAC name is 7-fluorospiro[1,4-dihydroquinoxaline-3,3'-oxolane]-2-one.

Molecular Properties

Compound Name7-fluorospiro[1,4-dihydroquinoxaline-3,3'-oxolane]-2-one
PubChem CID79295412
Molecular FormulaC11H11FN2O2
Molecular Weight222.22 g/mol
Exact Mass222.08
IUPAC Name7-fluorospiro[1,4-dihydroquinoxaline-3,3'-oxolane]-2-one
SMILESO=C1Nc2cc(F)ccc2NC12CCOC2
InChIInChI=1S/C11H11FN2O2/c12-7-1-2-8-9(5-7)13-10(15)11(14-8)3-4-16-6-11/h1-2,5,14H,3-4,6H2,(H,13,15)
InChIKeyDWBAFEIARAWMLH-UHFFFAOYSA-N
XLogP1.35
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.22
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-fluorospiro[1,4-dihydroquinoxaline-3,3'-oxolane]-2-one?
The IUPAC name of 7-fluorospiro[1,4-dihydroquinoxaline-3,3'-oxolane]-2-one (CID 79295412) is 7-fluorospiro[1,4-dihydroquinoxaline-3,3'-oxolane]-2-one.
What is the SMILES notation for 7-fluorospiro[1,4-dihydroquinoxaline-3,3'-oxolane]-2-one?
The canonical SMILES for 7-fluorospiro[1,4-dihydroquinoxaline-3,3'-oxolane]-2-one is O=C1Nc2cc(F)ccc2NC12CCOC2.
What is the InChIKey of 7-fluorospiro[1,4-dihydroquinoxaline-3,3'-oxolane]-2-one?
The InChIKey is DWBAFEIARAWMLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN2O2/c12-7-1-2-8-9(5-7)13-10(15)11(14-8)3-4-16-6-11/h1-2,5,14H,3-4,6H2,(H,13,15).
What are the key properties of 7-fluorospiro[1,4-dihydroquinoxaline-3,3'-oxolane]-2-one?
7-fluorospiro[1,4-dihydroquinoxaline-3,3'-oxolane]-2-one has a molecular weight of 222.22 g/mol, XLogP of 1.35, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluorospiro[1,4-dihydroquinoxaline-3,3'-oxolane]-2-one is sourced from PubChem (CID 79295412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).