5-fluoro-7H-indole

C8H6FN — CID 97295149

IUPAC5-fluoro-7H-indole
SMILESFC1=CCC2=NC=CC2=C1
InChIInChI=1S/C8H6FN/c9-7-1-2-8-6(5-7)3-4-10-8/h1,3-5H,2H2
InChIKeyUGXMJUNWTVBNKQ-UHFFFAOYSA-N
MW135.14 g/mol
LogP2.14
Rot. Bonds

About 5-fluoro-7H-indole

5-fluoro-7H-indole (PubChem CID 97295149) has the molecular formula C8H6FN and a molecular weight of 135.14 g/mol. Its IUPAC name is 5-fluoro-7H-indole.

Molecular Properties

Compound Name5-fluoro-7H-indole
PubChem CID97295149
Molecular FormulaC8H6FN
Molecular Weight135.14 g/mol
Exact Mass135.05
IUPAC Name5-fluoro-7H-indole
SMILESFC1=CCC2=NC=CC2=C1
InChIInChI=1S/C8H6FN/c9-7-1-2-8-6(5-7)3-4-10-8/h1,3-5H,2H2
InChIKeyUGXMJUNWTVBNKQ-UHFFFAOYSA-N
XLogP2.14
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.14
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-7H-indole?
The IUPAC name of 5-fluoro-7H-indole (CID 97295149) is 5-fluoro-7H-indole.
What is the SMILES notation for 5-fluoro-7H-indole?
The canonical SMILES for 5-fluoro-7H-indole is FC1=CCC2=NC=CC2=C1.
What is the InChIKey of 5-fluoro-7H-indole?
The InChIKey is UGXMJUNWTVBNKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6FN/c9-7-1-2-8-6(5-7)3-4-10-8/h1,3-5H,2H2.
What are the key properties of 5-fluoro-7H-indole?
5-fluoro-7H-indole has a molecular weight of 135.14 g/mol, XLogP of 2.14, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-7H-indole is sourced from PubChem (CID 97295149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).