2-(2-Fluorophenyl)-6-hydroxy-2,3-dihydroinden-1-one

C15H11FO2 — CID 141285969

IUPAC2-(2-fluorophenyl)-6-hydroxy-2,3-dihydroinden-1-one
SMILESC1C(C(=O)C2=C1C=CC(=C2)O)C3=CC=CC=C3F
InChIInChI=1S/C15H11FO2/c16-14-4-2-1-3-11(14)13-7-9-5-6-10(17)8-12(9)15(13)18/h1-6,8,13,17H,7H2
InChIKeyRNXSRVFOGPCCDL-UHFFFAOYSA-N
MW242.24 g/mol
LogP3.10
Rot. Bonds1

About 2-(2-Fluorophenyl)-6-hydroxy-2,3-dihydroinden-1-one

2-(2-Fluorophenyl)-6-hydroxy-2,3-dihydroinden-1-one (PubChem CID 141285969) has the molecular formula C15H11FO2 and a molecular weight of 242.24 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-6-hydroxy-2,3-dihydroinden-1-one.

Molecular Properties

Compound Name2-(2-Fluorophenyl)-6-hydroxy-2,3-dihydroinden-1-one
PubChem CID141285969
Molecular FormulaC15H11FO2
Molecular Weight242.24 g/mol
Exact Mass242.07
IUPAC Name2-(2-fluorophenyl)-6-hydroxy-2,3-dihydroinden-1-one
SMILESC1C(C(=O)C2=C1C=CC(=C2)O)C3=CC=CC=C3F
InChIInChI=1S/C15H11FO2/c16-14-4-2-1-3-11(14)13-7-9-5-6-10(17)8-12(9)15(13)18/h1-6,8,13,17H,7H2
InChIKeyRNXSRVFOGPCCDL-UHFFFAOYSA-N
XLogP3.10
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity330

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.24
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-Hydroxy-9-fluorenone
CID 16139
6-Hydroxy-3,4-dihydro-1(2H)-naphthalenone
CID 4679494
5-Hydroxy-1-tetralone
CID 119921
2-Hydroxyfluoren-9-one
CID 81386
3-Hydroxybenzophenone
CID 83050
4-Hydroxy-7-methyl-1-indanone
CID 5005111
3-bromo-6-hydroxy-2-(4-hydroxyphenyl)-1H-inden-1-one
CID 10286462
6-Ketoestrone
CID 12985714
2-(4-hydroxyphenyl)benzoic Acid
CID 2759303
7-hydroxy-3,4-dihydro-2H-naphthalen-1-one
CID 571818
4-Fluoro-4'-hydroxybenzophenone
CID 117666
5-Hydroxy-1-indanone
CID 233147

Frequently Asked Questions

What is the IUPAC name of 2-(2-Fluorophenyl)-6-hydroxy-2,3-dihydroinden-1-one?
The IUPAC name of 2-(2-Fluorophenyl)-6-hydroxy-2,3-dihydroinden-1-one (CID 141285969) is 2-(2-fluorophenyl)-6-hydroxy-2,3-dihydroinden-1-one.
What is the SMILES notation for 2-(2-Fluorophenyl)-6-hydroxy-2,3-dihydroinden-1-one?
The canonical SMILES for 2-(2-Fluorophenyl)-6-hydroxy-2,3-dihydroinden-1-one is C1C(C(=O)C2=C1C=CC(=C2)O)C3=CC=CC=C3F.
What is the InChIKey of 2-(2-Fluorophenyl)-6-hydroxy-2,3-dihydroinden-1-one?
The InChIKey is RNXSRVFOGPCCDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FO2/c16-14-4-2-1-3-11(14)13-7-9-5-6-10(17)8-12(9)15(13)18/h1-6,8,13,17H,7H2.
What are the key properties of 2-(2-Fluorophenyl)-6-hydroxy-2,3-dihydroinden-1-one?
2-(2-Fluorophenyl)-6-hydroxy-2,3-dihydroinden-1-one has a molecular weight of 242.24 g/mol, XLogP of 3.10, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-Fluorophenyl)-6-hydroxy-2,3-dihydroinden-1-one is sourced from PubChem (CID 141285969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).