5,6-dihydrofuro[2,3-c]pyrrol-4-one

C6H5NO2 — CID 55298926

IUPAC5,6-dihydrofuro[2,3-c]pyrrol-4-one
SMILESO=C1NCc2occc21
InChIInChI=1S/C6H5NO2/c8-6-4-1-2-9-5(4)3-7-6/h1-2H,3H2,(H,7,8)
InChIKeyYGCWQYOIPFWXLF-UHFFFAOYSA-N
MW123.11 g/mol
LogP0.52
Rot. Bonds

About 5,6-dihydrofuro[2,3-c]pyrrol-4-one

5,6-dihydrofuro[2,3-c]pyrrol-4-one (PubChem CID 55298926) has the molecular formula C6H5NO2 and a molecular weight of 123.11 g/mol. Its IUPAC name is 5,6-dihydrofuro[2,3-c]pyrrol-4-one.

Molecular Properties

Compound Name5,6-dihydrofuro[2,3-c]pyrrol-4-one
PubChem CID55298926
Molecular FormulaC6H5NO2
Molecular Weight123.11 g/mol
Exact Mass123.03
IUPAC Name5,6-dihydrofuro[2,3-c]pyrrol-4-one
SMILESO=C1NCc2occc21
InChIInChI=1S/C6H5NO2/c8-6-4-1-2-9-5(4)3-7-6/h1-2H,3H2,(H,7,8)
InChIKeyYGCWQYOIPFWXLF-UHFFFAOYSA-N
XLogP0.52
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.11
LogP ≤ 50.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5,6-dihydrofuro[2,3-c]pyrrol-4-one?
The IUPAC name of 5,6-dihydrofuro[2,3-c]pyrrol-4-one (CID 55298926) is 5,6-dihydrofuro[2,3-c]pyrrol-4-one.
What is the SMILES notation for 5,6-dihydrofuro[2,3-c]pyrrol-4-one?
The canonical SMILES for 5,6-dihydrofuro[2,3-c]pyrrol-4-one is O=C1NCc2occc21.
What is the InChIKey of 5,6-dihydrofuro[2,3-c]pyrrol-4-one?
The InChIKey is YGCWQYOIPFWXLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5NO2/c8-6-4-1-2-9-5(4)3-7-6/h1-2H,3H2,(H,7,8).
What are the key properties of 5,6-dihydrofuro[2,3-c]pyrrol-4-one?
5,6-dihydrofuro[2,3-c]pyrrol-4-one has a molecular weight of 123.11 g/mol, XLogP of 0.52, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dihydrofuro[2,3-c]pyrrol-4-one is sourced from PubChem (CID 55298926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).