4,7-difluoro-2-thiophen-2-yl-1H-indole

C12H7F2NS — CID 131867723

IUPAC4,7-difluoro-2-thiophen-2-yl-1H-indole
SMILESFc1ccc(F)c2[nH]c(-c3cccs3)cc12
InChIInChI=1S/C12H7F2NS/c13-8-3-4-9(14)12-7(8)6-10(15-12)11-2-1-5-16-11/h1-6,15H
InChIKeyXZCGARIKPNWBFC-UHFFFAOYSA-N
MW235.26 g/mol
LogP4.17
Rot. Bonds1

About 4,7-difluoro-2-thiophen-2-yl-1H-indole

4,7-difluoro-2-thiophen-2-yl-1H-indole (PubChem CID 131867723) has the molecular formula C12H7F2NS and a molecular weight of 235.26 g/mol. Its IUPAC name is 4,7-difluoro-2-thiophen-2-yl-1H-indole.

Molecular Properties

Compound Name4,7-difluoro-2-thiophen-2-yl-1H-indole
PubChem CID131867723
Molecular FormulaC12H7F2NS
Molecular Weight235.26 g/mol
Exact Mass235.03
IUPAC Name4,7-difluoro-2-thiophen-2-yl-1H-indole
SMILESFc1ccc(F)c2[nH]c(-c3cccs3)cc12
InChIInChI=1S/C12H7F2NS/c13-8-3-4-9(14)12-7(8)6-10(15-12)11-2-1-5-16-11/h1-6,15H
InChIKeyXZCGARIKPNWBFC-UHFFFAOYSA-N
XLogP4.17
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.26
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-fluoro-7-methyl-2-thiophen-2-yl-1H-indole
CID 131887170
5-fluoro-2-thiophen-2-yl-1H-indol-6-amine
CID 82390356
2-thiophen-2-yl-3H-benzo[e]indole
CID 131886269
3-methyl-2,5-dithiophen-2-yl-1H-pyrrole
CID 53445362
5-methyl-3-thiophen-2-yl-2H-isoquinolin-1-one
CID 142730761
4-[2-fluoro-5-(trifluoromethyl)phenyl]-2-oxo-6-thiophen-2-yl-1H-pyridine-3-carbonitrile
CID 19657053
4-sulfanylidene-6-thiophen-2-yl-1H-pyrimidin-2-one
CID 121206455
5-thiophen-2-yl-3,4-dihydro-1H-pyrrolo[3,2-b]pyrrol-2-one
CID 175436255
2-(3-fluoro-5-propan-2-ylphenyl)thiophene
CID 167222834
(2,5-dithiophen-2-yl-1H-pyrrol-3-yl)methanamine
CID 54273607
7-fluoro-2-(4-fluorophenyl)-1H-indol-4-amine
CID 82385922
thieno[3,2-b]thiophene;2-thiophen-2-yl-1,4-dihydropyrrolo[3,2-b]pyrrole-5,6-dione
CID 174225728

Frequently Asked Questions

What is the IUPAC name of 4,7-difluoro-2-thiophen-2-yl-1H-indole?
The IUPAC name of 4,7-difluoro-2-thiophen-2-yl-1H-indole (CID 131867723) is 4,7-difluoro-2-thiophen-2-yl-1H-indole.
What is the SMILES notation for 4,7-difluoro-2-thiophen-2-yl-1H-indole?
The canonical SMILES for 4,7-difluoro-2-thiophen-2-yl-1H-indole is Fc1ccc(F)c2[nH]c(-c3cccs3)cc12.
What is the InChIKey of 4,7-difluoro-2-thiophen-2-yl-1H-indole?
The InChIKey is XZCGARIKPNWBFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7F2NS/c13-8-3-4-9(14)12-7(8)6-10(15-12)11-2-1-5-16-11/h1-6,15H.
What are the key properties of 4,7-difluoro-2-thiophen-2-yl-1H-indole?
4,7-difluoro-2-thiophen-2-yl-1H-indole has a molecular weight of 235.26 g/mol, XLogP of 4.17, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,7-difluoro-2-thiophen-2-yl-1H-indole is sourced from PubChem (CID 131867723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).