4-fluoro-2,3-dihydro-1H-isoindole

C8H8FN — CID 14795867

IUPAC4-fluoro-2,3-dihydro-1H-isoindole
SMILESFc1cccc2c1CNC2
InChIInChI=1S/C8H8FN/c9-8-3-1-2-6-4-10-5-7(6)8/h1-3,10H,4-5H2
InChIKeyUDBMWFNXDSVYBR-UHFFFAOYSA-N
MW137.16 g/mol
LogP1.43
Rot. Bonds

About 4-fluoro-2,3-dihydro-1H-isoindole

4-fluoro-2,3-dihydro-1H-isoindole (PubChem CID 14795867) has the molecular formula C8H8FN and a molecular weight of 137.16 g/mol. Its IUPAC name is 4-fluoro-2,3-dihydro-1H-isoindole.

Molecular Properties

Compound Name4-fluoro-2,3-dihydro-1H-isoindole
PubChem CID14795867
Molecular FormulaC8H8FN
Molecular Weight137.16 g/mol
Exact Mass137.06
IUPAC Name4-fluoro-2,3-dihydro-1H-isoindole
SMILESFc1cccc2c1CNC2
InChIInChI=1S/C8H8FN/c9-8-3-1-2-6-4-10-5-7(6)8/h1-3,10H,4-5H2
InChIKeyUDBMWFNXDSVYBR-UHFFFAOYSA-N
XLogP1.43
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.16
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2,3-dihydro-1H-isoindole?
The IUPAC name of 4-fluoro-2,3-dihydro-1H-isoindole (CID 14795867) is 4-fluoro-2,3-dihydro-1H-isoindole.
What is the SMILES notation for 4-fluoro-2,3-dihydro-1H-isoindole?
The canonical SMILES for 4-fluoro-2,3-dihydro-1H-isoindole is Fc1cccc2c1CNC2.
What is the InChIKey of 4-fluoro-2,3-dihydro-1H-isoindole?
The InChIKey is UDBMWFNXDSVYBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8FN/c9-8-3-1-2-6-4-10-5-7(6)8/h1-3,10H,4-5H2.
What are the key properties of 4-fluoro-2,3-dihydro-1H-isoindole?
4-fluoro-2,3-dihydro-1H-isoindole has a molecular weight of 137.16 g/mol, XLogP of 1.43, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2,3-dihydro-1H-isoindole is sourced from PubChem (CID 14795867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).