6-fluoro-1,4-dihydroindole

C8H6FN — CID 176522870

IUPAC6-fluoro-1,4-dihydroindole
SMILESFC1=CCC2=C=CNC2=C1
InChIInChI=1S/C8H6FN/c9-7-2-1-6-3-4-10-8(6)5-7/h2,4-5,10H,1H2
InChIKeyXUBNTIOPXGOBAS-UHFFFAOYSA-N
MW135.14 g/mol
LogP1.77
Rot. Bonds

About 6-fluoro-1,4-dihydroindole

6-fluoro-1,4-dihydroindole (PubChem CID 176522870) has the molecular formula C8H6FN and a molecular weight of 135.14 g/mol. Its IUPAC name is 6-fluoro-1,4-dihydroindole.

Molecular Properties

Compound Name6-fluoro-1,4-dihydroindole
PubChem CID176522870
Molecular FormulaC8H6FN
Molecular Weight135.14 g/mol
Exact Mass135.05
IUPAC Name6-fluoro-1,4-dihydroindole
SMILESFC1=CCC2=C=CNC2=C1
InChIInChI=1S/C8H6FN/c9-7-2-1-6-3-4-10-8(6)5-7/h2,4-5,10H,1H2
InChIKeyXUBNTIOPXGOBAS-UHFFFAOYSA-N
XLogP1.77
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.14
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5,6-Dihydroindole
CID 57086633
5,6-Dihydrotryptamine
CID 67559680
Dihydro 5h cyclopenta[c]pyridine
CID 68168321
Cyclopentaquinoline
CID 87329973
Lithium 1,7-dihydroindol-7-ide
CID 134894157
6-chloro-5-fluoro-5,6-dihydro-1H-indole
CID 68343085
5-fluoro-2-methyl-2,4-dihydro-1H-indole
CID 89846202
1-[(2Z)-2-[(2E)-1,3-difluoropenta-2,4-dienylidene]-1,3-dihydropyrrol-4-yl]ethenamine
CID 118882786
4-fluoro-5,6-dihydro-1H-indole
CID 123307377
7-fluoro-4-methyl-5,6-dihydro-1H-indole
CID 123444746
1-[5-(2-fluorobut-2-enylidene)-4-methylidene-1H-pyrrol-3-yl]-N,N-dimethylmethanamine
CID 123887050
(3Z,5E)-5-fluoro-2,7,9,10-tetrahydro-1H-1-benzazonine
CID 135193072

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-1,4-dihydroindole?
The IUPAC name of 6-fluoro-1,4-dihydroindole (CID 176522870) is 6-fluoro-1,4-dihydroindole.
What is the SMILES notation for 6-fluoro-1,4-dihydroindole?
The canonical SMILES for 6-fluoro-1,4-dihydroindole is FC1=CCC2=C=CNC2=C1.
What is the InChIKey of 6-fluoro-1,4-dihydroindole?
The InChIKey is XUBNTIOPXGOBAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6FN/c9-7-2-1-6-3-4-10-8(6)5-7/h2,4-5,10H,1H2.
What are the key properties of 6-fluoro-1,4-dihydroindole?
6-fluoro-1,4-dihydroindole has a molecular weight of 135.14 g/mol, XLogP of 1.77, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-1,4-dihydroindole is sourced from PubChem (CID 176522870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).