spiro[1,4-dihydrofuro[2,3-b]pyrazine-2,1'-cyclopropane]-3-one

C8H8N2O2 — CID 82375673

IUPACspiro[1,4-dihydrofuro[2,3-b]pyrazine-2,1'-cyclopropane]-3-one
SMILESO=C1Nc2occc2NC12CC2
InChIInChI=1S/C8H8N2O2/c11-7-8(2-3-8)10-5-1-4-12-6(5)9-7/h1,4,10H,2-3H2,(H,9,11)
InChIKeyCXBSPLATALBZCU-UHFFFAOYSA-N
MW164.16 g/mol
LogP1.18
Rot. Bonds

About spiro[1,4-dihydrofuro[2,3-b]pyrazine-2,1'-cyclopropane]-3-one

spiro[1,4-dihydrofuro[2,3-b]pyrazine-2,1'-cyclopropane]-3-one (PubChem CID 82375673) has the molecular formula C8H8N2O2 and a molecular weight of 164.16 g/mol. Its IUPAC name is spiro[1,4-dihydrofuro[2,3-b]pyrazine-2,1'-cyclopropane]-3-one.

Molecular Properties

Compound Namespiro[1,4-dihydrofuro[2,3-b]pyrazine-2,1'-cyclopropane]-3-one
PubChem CID82375673
Molecular FormulaC8H8N2O2
Molecular Weight164.16 g/mol
Exact Mass164.06
IUPAC Namespiro[1,4-dihydrofuro[2,3-b]pyrazine-2,1'-cyclopropane]-3-one
SMILESO=C1Nc2occc2NC12CC2
InChIInChI=1S/C8H8N2O2/c11-7-8(2-3-8)10-5-1-4-12-6(5)9-7/h1,4,10H,2-3H2,(H,9,11)
InChIKeyCXBSPLATALBZCU-UHFFFAOYSA-N
XLogP1.18
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.16
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of spiro[1,4-dihydrofuro[2,3-b]pyrazine-2,1'-cyclopropane]-3-one?
The IUPAC name of spiro[1,4-dihydrofuro[2,3-b]pyrazine-2,1'-cyclopropane]-3-one (CID 82375673) is spiro[1,4-dihydrofuro[2,3-b]pyrazine-2,1'-cyclopropane]-3-one.
What is the SMILES notation for spiro[1,4-dihydrofuro[2,3-b]pyrazine-2,1'-cyclopropane]-3-one?
The canonical SMILES for spiro[1,4-dihydrofuro[2,3-b]pyrazine-2,1'-cyclopropane]-3-one is O=C1Nc2occc2NC12CC2.
What is the InChIKey of spiro[1,4-dihydrofuro[2,3-b]pyrazine-2,1'-cyclopropane]-3-one?
The InChIKey is CXBSPLATALBZCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2O2/c11-7-8(2-3-8)10-5-1-4-12-6(5)9-7/h1,4,10H,2-3H2,(H,9,11).
What are the key properties of spiro[1,4-dihydrofuro[2,3-b]pyrazine-2,1'-cyclopropane]-3-one?
spiro[1,4-dihydrofuro[2,3-b]pyrazine-2,1'-cyclopropane]-3-one has a molecular weight of 164.16 g/mol, XLogP of 1.18, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[1,4-dihydrofuro[2,3-b]pyrazine-2,1'-cyclopropane]-3-one is sourced from PubChem (CID 82375673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).