5-fluoro-2-thiophen-2-yl-1H-indol-6-amine

C12H9FN2S — CID 82390356

IUPAC5-fluoro-2-thiophen-2-yl-1H-indol-6-amine
SMILESNc1cc2[nH]c(-c3cccs3)cc2cc1F
InChIInChI=1S/C12H9FN2S/c13-8-4-7-5-11(12-2-1-3-16-12)15-10(7)6-9(8)14/h1-6,15H,14H2
InChIKeyULFXPGJVGGTPBD-UHFFFAOYSA-N
MW232.28 g/mol
LogP3.62
Rot. Bonds1

About 5-fluoro-2-thiophen-2-yl-1H-indol-6-amine

5-fluoro-2-thiophen-2-yl-1H-indol-6-amine (PubChem CID 82390356) has the molecular formula C12H9FN2S and a molecular weight of 232.28 g/mol. Its IUPAC name is 5-fluoro-2-thiophen-2-yl-1H-indol-6-amine.

Molecular Properties

Compound Name5-fluoro-2-thiophen-2-yl-1H-indol-6-amine
PubChem CID82390356
Molecular FormulaC12H9FN2S
Molecular Weight232.28 g/mol
Exact Mass232.05
IUPAC Name5-fluoro-2-thiophen-2-yl-1H-indol-6-amine
SMILESNc1cc2[nH]c(-c3cccs3)cc2cc1F
InChIInChI=1S/C12H9FN2S/c13-8-4-7-5-11(12-2-1-3-16-12)15-10(7)6-9(8)14/h1-6,15H,14H2
InChIKeyULFXPGJVGGTPBD-UHFFFAOYSA-N
XLogP3.62
TPSA41.81 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

4,7-difluoro-2-thiophen-2-yl-1H-indole
CID 131867723
2-thiophen-2-yl-3H-benzo[e]indole
CID 131886269
3-(5-amino-6-fluoro-1H-indol-2-yl)phenol
CID 82387044
4-fluoro-7-methyl-2-thiophen-2-yl-1H-indole
CID 131887170
2-(1,3-dimethylpyrazol-4-yl)-5-fluoro-1H-indol-6-amine
CID 82385817
(2,5-dithiophen-2-yl-1H-pyrrol-3-yl)methanamine
CID 54273607
3-methyl-2,5-dithiophen-2-yl-1H-pyrrole
CID 53445362
4-fluoro-2-thiophen-2-yl-1H-benzimidazole
CID 60978499
4-sulfanylidene-6-thiophen-2-yl-1H-pyrimidin-2-one
CID 121206455
2-thiophen-2-ylbenzene-1,3-diamine
CID 69383856
2-ethyl-6-thiophen-2-yl-1H-pyrimidine-4-thione
CID 106515564
5-methyl-3-thiophen-2-yl-2H-isoquinolin-1-one
CID 142730761

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-thiophen-2-yl-1H-indol-6-amine?
The IUPAC name of 5-fluoro-2-thiophen-2-yl-1H-indol-6-amine (CID 82390356) is 5-fluoro-2-thiophen-2-yl-1H-indol-6-amine.
What is the SMILES notation for 5-fluoro-2-thiophen-2-yl-1H-indol-6-amine?
The canonical SMILES for 5-fluoro-2-thiophen-2-yl-1H-indol-6-amine is Nc1cc2[nH]c(-c3cccs3)cc2cc1F.
What is the InChIKey of 5-fluoro-2-thiophen-2-yl-1H-indol-6-amine?
The InChIKey is ULFXPGJVGGTPBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9FN2S/c13-8-4-7-5-11(12-2-1-3-16-12)15-10(7)6-9(8)14/h1-6,15H,14H2.
What are the key properties of 5-fluoro-2-thiophen-2-yl-1H-indol-6-amine?
5-fluoro-2-thiophen-2-yl-1H-indol-6-amine has a molecular weight of 232.28 g/mol, XLogP of 3.62, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-thiophen-2-yl-1H-indol-6-amine is sourced from PubChem (CID 82390356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).