3,8-dihydro-2H-furo[3,2-g]indole-6,7-dione

C10H7NO3 — CID 170552190

IUPAC3,8-dihydro-2H-furo[3,2-g]indole-6,7-dione
SMILESO=C1Nc2c(ccc3c2OCC3)C1=O
InChIInChI=1S/C10H7NO3/c12-8-6-2-1-5-3-4-14-9(5)7(6)11-10(8)13/h1-2H,3-4H2,(H,11,12,13)
InChIKeyIMVBQIMAILBOCD-UHFFFAOYSA-N
MW189.17 g/mol
LogP0.76
Rot. Bonds

About 3,8-dihydro-2H-furo[3,2-g]indole-6,7-dione

3,8-dihydro-2H-furo[3,2-g]indole-6,7-dione (PubChem CID 170552190) has the molecular formula C10H7NO3 and a molecular weight of 189.17 g/mol. Its IUPAC name is 3,8-dihydro-2H-furo[3,2-g]indole-6,7-dione.

Molecular Properties

Compound Name3,8-dihydro-2H-furo[3,2-g]indole-6,7-dione
PubChem CID170552190
Molecular FormulaC10H7NO3
Molecular Weight189.17 g/mol
Exact Mass189.04
IUPAC Name3,8-dihydro-2H-furo[3,2-g]indole-6,7-dione
SMILESO=C1Nc2c(ccc3c2OCC3)C1=O
InChIInChI=1S/C10H7NO3/c12-8-6-2-1-5-3-4-14-9(5)7(6)11-10(8)13/h1-2H,3-4H2,(H,11,12,13)
InChIKeyIMVBQIMAILBOCD-UHFFFAOYSA-N
XLogP0.76
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.17
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3,8-dihydro-2H-furo[3,2-g]indole-6,7-dione?
The IUPAC name of 3,8-dihydro-2H-furo[3,2-g]indole-6,7-dione (CID 170552190) is 3,8-dihydro-2H-furo[3,2-g]indole-6,7-dione.
What is the SMILES notation for 3,8-dihydro-2H-furo[3,2-g]indole-6,7-dione?
The canonical SMILES for 3,8-dihydro-2H-furo[3,2-g]indole-6,7-dione is O=C1Nc2c(ccc3c2OCC3)C1=O.
What is the InChIKey of 3,8-dihydro-2H-furo[3,2-g]indole-6,7-dione?
The InChIKey is IMVBQIMAILBOCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7NO3/c12-8-6-2-1-5-3-4-14-9(5)7(6)11-10(8)13/h1-2H,3-4H2,(H,11,12,13).
What are the key properties of 3,8-dihydro-2H-furo[3,2-g]indole-6,7-dione?
3,8-dihydro-2H-furo[3,2-g]indole-6,7-dione has a molecular weight of 189.17 g/mol, XLogP of 0.76, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,8-dihydro-2H-furo[3,2-g]indole-6,7-dione is sourced from PubChem (CID 170552190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).