5-fluoro-3-(3H-indol-2-yl)-1H-indol-2-ol

C16H11FN2O — CID 170658220

IUPAC5-fluoro-3-(3H-indol-2-yl)-1H-indol-2-ol
SMILESOc1[nH]c2ccc(F)cc2c1C1=Nc2ccccc2C1
InChIInChI=1S/C16H11FN2O/c17-10-5-6-13-11(8-10)15(16(20)19-13)14-7-9-3-1-2-4-12(9)18-14/h1-6,8,19-20H,7H2
InChIKeyCEESPTYAGXQQLW-UHFFFAOYSA-N
MW266.27 g/mol
LogP3.69
Rot. Bonds1

About 5-fluoro-3-(3H-indol-2-yl)-1H-indol-2-ol

5-fluoro-3-(3H-indol-2-yl)-1H-indol-2-ol (PubChem CID 170658220) has the molecular formula C16H11FN2O and a molecular weight of 266.27 g/mol. Its IUPAC name is 5-fluoro-3-(3H-indol-2-yl)-1H-indol-2-ol.

Molecular Properties

Compound Name5-fluoro-3-(3H-indol-2-yl)-1H-indol-2-ol
PubChem CID170658220
Molecular FormulaC16H11FN2O
Molecular Weight266.27 g/mol
Exact Mass266.09
IUPAC Name5-fluoro-3-(3H-indol-2-yl)-1H-indol-2-ol
SMILESOc1[nH]c2ccc(F)cc2c1C1=Nc2ccccc2C1
InChIInChI=1S/C16H11FN2O/c17-10-5-6-13-11(8-10)15(16(20)19-13)14-7-9-3-1-2-4-12(9)18-14/h1-6,8,19-20H,7H2
InChIKeyCEESPTYAGXQQLW-UHFFFAOYSA-N
XLogP3.69
TPSA48.38 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.27
LogP ≤ 53.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-fluoro-2-(5-fluoro-2-hydroxy-1H-indol-3-yl)indol-3-one
CID 135873274
2-(1H-indol-3-yl)-3H-indole
CID 163416742
2-(5-chloro-2-hydroxy-1H-indol-3-yl)-5-fluoroindol-3-one
CID 135873261
5-fluoro-3-[(3E)-3-[2-(piperidin-4-ylamino)ethoxyimino]indol-2-yl]-1H-indol-2-ol
CID 142752486
4-chloro-2-(3H-indol-2-yl)phenol
CID 158565703
2-fluoro-3H-indole
CID 174790270
ethane;2-[4-(3H-indol-2-yl)phenyl]-3H-indole
CID 91030329
5-chloro-3-(3-nitroso-1H-inden-2-yl)-1H-indol-2-ol
CID 158774254
CID 174027584
CID 174027584
5-fluoro-3-[(2,3,5,6-tetrafluoro-4-pyridinyl)diazenyl]-1H-indol-2-ol
CID 135673583
benzene;ethane;2-phenyl-3H-indole
CID 91573421
1-[(1S,4S)-2,5-diazabicyclo[2.2.1]heptan-2-yl]-2-[(E)-[2-(5-fluoro-2-hydroxy-1H-indol-3-yl)indol-3-ylidene]amino]oxyethanone
CID 170658214

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-3-(3H-indol-2-yl)-1H-indol-2-ol?
The IUPAC name of 5-fluoro-3-(3H-indol-2-yl)-1H-indol-2-ol (CID 170658220) is 5-fluoro-3-(3H-indol-2-yl)-1H-indol-2-ol.
What is the SMILES notation for 5-fluoro-3-(3H-indol-2-yl)-1H-indol-2-ol?
The canonical SMILES for 5-fluoro-3-(3H-indol-2-yl)-1H-indol-2-ol is Oc1[nH]c2ccc(F)cc2c1C1=Nc2ccccc2C1.
What is the InChIKey of 5-fluoro-3-(3H-indol-2-yl)-1H-indol-2-ol?
The InChIKey is CEESPTYAGXQQLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11FN2O/c17-10-5-6-13-11(8-10)15(16(20)19-13)14-7-9-3-1-2-4-12(9)18-14/h1-6,8,19-20H,7H2.
What are the key properties of 5-fluoro-3-(3H-indol-2-yl)-1H-indol-2-ol?
5-fluoro-3-(3H-indol-2-yl)-1H-indol-2-ol has a molecular weight of 266.27 g/mol, XLogP of 3.69, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-3-(3H-indol-2-yl)-1H-indol-2-ol is sourced from PubChem (CID 170658220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).