5-fluorospiro[1H-indole-3,3'-5,6-dihydro-2H-furo[3,2-f][1]benzofuran]-2-one

C17H12FNO3 — CID 59352505

IUPAC5-fluorospiro[1H-indole-3,3'-5,6-dihydro-2H-furo[3,2-f][1]benzofuran]-2-one
SMILESO=C1Nc2ccc(F)cc2C12COc1cc3c(cc12)CCO3
InChIInChI=1S/C17H12FNO3/c18-10-1-2-13-11(6-10)17(16(20)19-13)8-22-15-7-14-9(3-4-21-14)5-12(15)17/h1-2,5-7H,3-4,8H2,(H,19,20)
InChIKeyAAGROAPUULTVLE-UHFFFAOYSA-N
MW297.29 g/mol
LogP2.39
Rot. Bonds

About 5-fluorospiro[1H-indole-3,3'-5,6-dihydro-2H-furo[3,2-f][1]benzofuran]-2-one

5-fluorospiro[1H-indole-3,3'-5,6-dihydro-2H-furo[3,2-f][1]benzofuran]-2-one (PubChem CID 59352505) has the molecular formula C17H12FNO3 and a molecular weight of 297.29 g/mol. Its IUPAC name is 5-fluorospiro[1H-indole-3,3'-5,6-dihydro-2H-furo[3,2-f][1]benzofuran]-2-one.

Molecular Properties

Compound Name5-fluorospiro[1H-indole-3,3'-5,6-dihydro-2H-furo[3,2-f][1]benzofuran]-2-one
PubChem CID59352505
Molecular FormulaC17H12FNO3
Molecular Weight297.29 g/mol
Exact Mass297.08
IUPAC Name5-fluorospiro[1H-indole-3,3'-5,6-dihydro-2H-furo[3,2-f][1]benzofuran]-2-one
SMILESO=C1Nc2ccc(F)cc2C12COc1cc3c(cc12)CCO3
InChIInChI=1S/C17H12FNO3/c18-10-1-2-13-11(6-10)17(16(20)19-13)8-22-15-7-14-9(3-4-21-14)5-12(15)17/h1-2,5-7H,3-4,8H2,(H,19,20)
InChIKeyAAGROAPUULTVLE-UHFFFAOYSA-N
XLogP2.39
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.29
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-fluorospiro[1H-indole-3,3'-5,6-dihydro-2H-furo[3,2-f][1]benzofuran]-2-one?
The IUPAC name of 5-fluorospiro[1H-indole-3,3'-5,6-dihydro-2H-furo[3,2-f][1]benzofuran]-2-one (CID 59352505) is 5-fluorospiro[1H-indole-3,3'-5,6-dihydro-2H-furo[3,2-f][1]benzofuran]-2-one.
What is the SMILES notation for 5-fluorospiro[1H-indole-3,3'-5,6-dihydro-2H-furo[3,2-f][1]benzofuran]-2-one?
The canonical SMILES for 5-fluorospiro[1H-indole-3,3'-5,6-dihydro-2H-furo[3,2-f][1]benzofuran]-2-one is O=C1Nc2ccc(F)cc2C12COc1cc3c(cc12)CCO3.
What is the InChIKey of 5-fluorospiro[1H-indole-3,3'-5,6-dihydro-2H-furo[3,2-f][1]benzofuran]-2-one?
The InChIKey is AAGROAPUULTVLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12FNO3/c18-10-1-2-13-11(6-10)17(16(20)19-13)8-22-15-7-14-9(3-4-21-14)5-12(15)17/h1-2,5-7H,3-4,8H2,(H,19,20).
What are the key properties of 5-fluorospiro[1H-indole-3,3'-5,6-dihydro-2H-furo[3,2-f][1]benzofuran]-2-one?
5-fluorospiro[1H-indole-3,3'-5,6-dihydro-2H-furo[3,2-f][1]benzofuran]-2-one has a molecular weight of 297.29 g/mol, XLogP of 2.39, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluorospiro[1H-indole-3,3'-5,6-dihydro-2H-furo[3,2-f][1]benzofuran]-2-one is sourced from PubChem (CID 59352505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).