5'-fluorospiro[1,3-dithiolane-2,3'-1H-indole]-2'-one

C10H8FNOS2 — CID 1262135

IUPAC5'-fluorospiro[1,3-dithiolane-2,3'-1H-indole]-2'-one
SMILESO=C1Nc2ccc(F)cc2C12SCCS2
InChIInChI=1S/C10H8FNOS2/c11-6-1-2-8-7(5-6)10(9(13)12-8)14-3-4-15-10/h1-2,5H,3-4H2,(H,12,13)
InChIKeyOUFKUJJPYFOWMZ-UHFFFAOYSA-N
MW241.31 g/mol
LogP2.41
Rot. Bonds

About 5'-fluorospiro[1,3-dithiolane-2,3'-1H-indole]-2'-one

5'-fluorospiro[1,3-dithiolane-2,3'-1H-indole]-2'-one (PubChem CID 1262135) has the molecular formula C10H8FNOS2 and a molecular weight of 241.31 g/mol. Its IUPAC name is 5'-fluorospiro[1,3-dithiolane-2,3'-1H-indole]-2'-one.

Molecular Properties

Compound Name5'-fluorospiro[1,3-dithiolane-2,3'-1H-indole]-2'-one
PubChem CID1262135
Molecular FormulaC10H8FNOS2
Molecular Weight241.31 g/mol
Exact Mass241.00
IUPAC Name5'-fluorospiro[1,3-dithiolane-2,3'-1H-indole]-2'-one
SMILESO=C1Nc2ccc(F)cc2C12SCCS2
InChIInChI=1S/C10H8FNOS2/c11-6-1-2-8-7(5-6)10(9(13)12-8)14-3-4-15-10/h1-2,5H,3-4H2,(H,12,13)
InChIKeyOUFKUJJPYFOWMZ-UHFFFAOYSA-N
XLogP2.41
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.31
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5'-fluorospiro[1,3-dithiolane-2,3'-1H-indole]-2'-one?
The IUPAC name of 5'-fluorospiro[1,3-dithiolane-2,3'-1H-indole]-2'-one (CID 1262135) is 5'-fluorospiro[1,3-dithiolane-2,3'-1H-indole]-2'-one.
What is the SMILES notation for 5'-fluorospiro[1,3-dithiolane-2,3'-1H-indole]-2'-one?
The canonical SMILES for 5'-fluorospiro[1,3-dithiolane-2,3'-1H-indole]-2'-one is O=C1Nc2ccc(F)cc2C12SCCS2.
What is the InChIKey of 5'-fluorospiro[1,3-dithiolane-2,3'-1H-indole]-2'-one?
The InChIKey is OUFKUJJPYFOWMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8FNOS2/c11-6-1-2-8-7(5-6)10(9(13)12-8)14-3-4-15-10/h1-2,5H,3-4H2,(H,12,13).
What are the key properties of 5'-fluorospiro[1,3-dithiolane-2,3'-1H-indole]-2'-one?
5'-fluorospiro[1,3-dithiolane-2,3'-1H-indole]-2'-one has a molecular weight of 241.31 g/mol, XLogP of 2.41, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5'-fluorospiro[1,3-dithiolane-2,3'-1H-indole]-2'-one is sourced from PubChem (CID 1262135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).