6-fluoro-2H-isoindol-1-ol

C8H6FNO — CID 54270389

IUPAC6-fluoro-2H-isoindol-1-ol
SMILESOc1[nH]cc2ccc(F)cc12
InChIInChI=1S/C8H6FNO/c9-6-2-1-5-4-10-8(11)7(5)3-6/h1-4,10-11H
InChIKeyRJRXBYHJSAJYGW-UHFFFAOYSA-N
MW151.14 g/mol
LogP2.01
Rot. Bonds

About 6-fluoro-2H-isoindol-1-ol

6-fluoro-2H-isoindol-1-ol (PubChem CID 54270389) has the molecular formula C8H6FNO and a molecular weight of 151.14 g/mol. Its IUPAC name is 6-fluoro-2H-isoindol-1-ol.

Molecular Properties

Compound Name6-fluoro-2H-isoindol-1-ol
PubChem CID54270389
Molecular FormulaC8H6FNO
Molecular Weight151.14 g/mol
Exact Mass151.04
IUPAC Name6-fluoro-2H-isoindol-1-ol
SMILESOc1[nH]cc2ccc(F)cc12
InChIInChI=1S/C8H6FNO/c9-6-2-1-5-4-10-8(11)7(5)3-6/h1-4,10-11H
InChIKeyRJRXBYHJSAJYGW-UHFFFAOYSA-N
XLogP2.01
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.14
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze 6-fluoro-2H-isoindol-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Isoindolol
CID 21225249
Isoindol-5-ol
CID 21560857
Dihydroxyisoindole
CID 53631839
Hydroxypyrrolo[3,4-c]pyridine
CID 53910923
1-methoxy-2H-isoindole
CID 91389894
2H-isoindol-1-yl bis(2,3,4,5,6-pentafluorophenyl) borate
CID 18400450
4-fluoro-2H-isoindol-1-ol
CID 54413322
2H-isoindol-1-yloxy-(2,3,4,5,6-pentafluorophenoxy)borinic acid
CID 88257609
6-Fluoro-2-[(4-fluorophenyl)methyl]-7-methylisoindol-1-ol
CID 90705871
5-[2-(3,4-difluorophenyl)ethynyl]-2H-isoindol-1-ol
CID 90731778
2-[(4-Fluorophenyl)methyl]-7-iodoisoindol-1-ol
CID 90733817
7-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2H-isoindol-1-ol
CID 90739493

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-2H-isoindol-1-ol?
The IUPAC name of 6-fluoro-2H-isoindol-1-ol (CID 54270389) is 6-fluoro-2H-isoindol-1-ol.
What is the SMILES notation for 6-fluoro-2H-isoindol-1-ol?
The canonical SMILES for 6-fluoro-2H-isoindol-1-ol is Oc1[nH]cc2ccc(F)cc12.
What is the InChIKey of 6-fluoro-2H-isoindol-1-ol?
The InChIKey is RJRXBYHJSAJYGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6FNO/c9-6-2-1-5-4-10-8(11)7(5)3-6/h1-4,10-11H.
What are the key properties of 6-fluoro-2H-isoindol-1-ol?
6-fluoro-2H-isoindol-1-ol has a molecular weight of 151.14 g/mol, XLogP of 2.01, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-2H-isoindol-1-ol is sourced from PubChem (CID 54270389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).