6-fluoro-7-methyl-2H-isoindol-1-ol

C9H8FNO — CID 90923682

IUPAC6-fluoro-7-methyl-2H-isoindol-1-ol
SMILESCc1c(F)ccc2c[nH]c(O)c12
InChIInChI=1S/C9H8FNO/c1-5-7(10)3-2-6-4-11-9(12)8(5)6/h2-4,11-12H,1H3
InChIKeyBIRXGAWRAXUVJR-UHFFFAOYSA-N
MW165.17 g/mol
LogP2.32
Rot. Bonds

About 6-fluoro-7-methyl-2H-isoindol-1-ol

6-fluoro-7-methyl-2H-isoindol-1-ol (PubChem CID 90923682) has the molecular formula C9H8FNO and a molecular weight of 165.17 g/mol. Its IUPAC name is 6-fluoro-7-methyl-2H-isoindol-1-ol.

Molecular Properties

Compound Name6-fluoro-7-methyl-2H-isoindol-1-ol
PubChem CID90923682
Molecular FormulaC9H8FNO
Molecular Weight165.17 g/mol
Exact Mass165.06
IUPAC Name6-fluoro-7-methyl-2H-isoindol-1-ol
SMILESCc1c(F)ccc2c[nH]c(O)c12
InChIInChI=1S/C9H8FNO/c1-5-7(10)3-2-6-4-11-9(12)8(5)6/h2-4,11-12H,1H3
InChIKeyBIRXGAWRAXUVJR-UHFFFAOYSA-N
XLogP2.32
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.17
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

4-amino-7-fluoro-2H-isoindol-1-ol
CID 91052579
2,8-difluoro-1-methylnaphthalene
CID 138605112
3,6-difluoro-2-methylphenol
CID 66721696
ethane;6-fluoro-4,5-dimethylisoquinoline
CID 171535835
4-amino-2-(2,6-difluorophenyl)-6H-pyrrolo[3,4-b]pyridin-5-ol
CID 137083284
5-fluoro-3-methyl-4-sulfanyl-1H-indol-2-ol
CID 150176127
2-(2-fluoro-6-methylphenyl)-4-propan-2-yl-6H-pyrrolo[3,4-d]pyrimidin-5-ol
CID 137047511
(7-fluoro-3-hydroxy-8-methylnaphthalen-1-yl) 2,2-dimethylpropanoate
CID 164534939
5-fluoro-4-methyl-1H-indole
CID 19848907
4-fluoro-3-methyl-2-(trifluoromethyl)phenol
CID 171020836
4,6-dichloro-7-fluoro-2H-pyrrolo[3,4-c]pyridin-3-ol
CID 137159263
2-(2,6-difluorophenyl)-4-(4-ethylanilino)-6H-pyrrolo[3,4-d]pyrimidin-5-ol
CID 137019000

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-7-methyl-2H-isoindol-1-ol?
The IUPAC name of 6-fluoro-7-methyl-2H-isoindol-1-ol (CID 90923682) is 6-fluoro-7-methyl-2H-isoindol-1-ol.
What is the SMILES notation for 6-fluoro-7-methyl-2H-isoindol-1-ol?
The canonical SMILES for 6-fluoro-7-methyl-2H-isoindol-1-ol is Cc1c(F)ccc2c[nH]c(O)c12.
What is the InChIKey of 6-fluoro-7-methyl-2H-isoindol-1-ol?
The InChIKey is BIRXGAWRAXUVJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8FNO/c1-5-7(10)3-2-6-4-11-9(12)8(5)6/h2-4,11-12H,1H3.
What are the key properties of 6-fluoro-7-methyl-2H-isoindol-1-ol?
6-fluoro-7-methyl-2H-isoindol-1-ol has a molecular weight of 165.17 g/mol, XLogP of 2.32, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-7-methyl-2H-isoindol-1-ol is sourced from PubChem (CID 90923682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).