2-(2,3-dihydro-1H-inden-1-yl)-6-fluorophenol

C15H13FO — CID 173126795

IUPAC2-(2,3-dihydro-1H-inden-1-yl)-6-fluorophenol
SMILESOc1c(F)cccc1C1CCc2ccccc21
InChIInChI=1S/C15H13FO/c16-14-7-3-6-13(15(14)17)12-9-8-10-4-1-2-5-11(10)12/h1-7,12,17H,8-9H2
InChIKeyGZYGLMJHOWMAHD-UHFFFAOYSA-N
MW228.27 g/mol
LogP3.61
Rot. Bonds1

About 2-(2,3-dihydro-1H-inden-1-yl)-6-fluorophenol

2-(2,3-dihydro-1H-inden-1-yl)-6-fluorophenol (PubChem CID 173126795) has the molecular formula C15H13FO and a molecular weight of 228.27 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-inden-1-yl)-6-fluorophenol.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-inden-1-yl)-6-fluorophenol
PubChem CID173126795
Molecular FormulaC15H13FO
Molecular Weight228.27 g/mol
Exact Mass228.10
IUPAC Name2-(2,3-dihydro-1H-inden-1-yl)-6-fluorophenol
SMILESOc1c(F)cccc1C1CCc2ccccc21
InChIInChI=1S/C15H13FO/c16-14-7-3-6-13(15(14)17)12-9-8-10-4-1-2-5-11(10)12/h1-7,12,17H,8-9H2
InChIKeyGZYGLMJHOWMAHD-UHFFFAOYSA-N
XLogP3.61
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.27
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-inden-1-yl)-6-fluorophenol?
The IUPAC name of 2-(2,3-dihydro-1H-inden-1-yl)-6-fluorophenol (CID 173126795) is 2-(2,3-dihydro-1H-inden-1-yl)-6-fluorophenol.
What is the SMILES notation for 2-(2,3-dihydro-1H-inden-1-yl)-6-fluorophenol?
The canonical SMILES for 2-(2,3-dihydro-1H-inden-1-yl)-6-fluorophenol is Oc1c(F)cccc1C1CCc2ccccc21.
What is the InChIKey of 2-(2,3-dihydro-1H-inden-1-yl)-6-fluorophenol?
The InChIKey is GZYGLMJHOWMAHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FO/c16-14-7-3-6-13(15(14)17)12-9-8-10-4-1-2-5-11(10)12/h1-7,12,17H,8-9H2.
What are the key properties of 2-(2,3-dihydro-1H-inden-1-yl)-6-fluorophenol?
2-(2,3-dihydro-1H-inden-1-yl)-6-fluorophenol has a molecular weight of 228.27 g/mol, XLogP of 3.61, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-inden-1-yl)-6-fluorophenol is sourced from PubChem (CID 173126795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).