3-(8-fluoro-2H-chromen-4-yl)-1H-indole

C17H12FNO — CID 141330389

IUPAC3-(8-fluoro-2H-chromen-4-yl)-1H-indole
SMILESFc1cccc2c1OCC=C2c1c[nH]c2ccccc12
InChIInChI=1S/C17H12FNO/c18-15-6-3-5-13-11(8-9-20-17(13)15)14-10-19-16-7-2-1-4-12(14)16/h1-8,10,19H,9H2
InChIKeyNUJKEFWOIQLVGA-UHFFFAOYSA-N
MW265.29 g/mol
LogP4.13
Rot. Bonds1

About 3-(8-fluoro-2H-chromen-4-yl)-1H-indole

3-(8-fluoro-2H-chromen-4-yl)-1H-indole (PubChem CID 141330389) has the molecular formula C17H12FNO and a molecular weight of 265.29 g/mol. Its IUPAC name is 3-(8-fluoro-2H-chromen-4-yl)-1H-indole.

Molecular Properties

Compound Name3-(8-fluoro-2H-chromen-4-yl)-1H-indole
PubChem CID141330389
Molecular FormulaC17H12FNO
Molecular Weight265.29 g/mol
Exact Mass265.09
IUPAC Name3-(8-fluoro-2H-chromen-4-yl)-1H-indole
SMILESFc1cccc2c1OCC=C2c1c[nH]c2ccccc12
InChIInChI=1S/C17H12FNO/c18-15-6-3-5-13-11(8-9-20-17(13)15)14-10-19-16-7-2-1-4-12(14)16/h1-8,10,19H,9H2
InChIKeyNUJKEFWOIQLVGA-UHFFFAOYSA-N
XLogP4.13
TPSA25.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.29
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-(6-fluoro-2H-thiochromen-4-yl)-1H-indole
CID 71680040
3-[4-(1H-indol-3-yl)phenyl]-1H-indole
CID 175007681
2-(1H-indol-3-yl)aniline
CID 25210227
3-(6-methyl-2H-thiochromen-4-yl)-1H-indole
CID 71680209
5-(1H-indol-3-yl)-2,3-dihydro-1H-1,4-benzodiazepine
CID 27783
methane;3-phenyl-1H-indole
CID 167711687
3-(1-methylpyrazol-4-yl)-1H-indole
CID 118064780
3-pyridin-4-yl-1H-indole
CID 159430533
4-(1H-indol-3-yl)-1,3-oxazole
CID 45276627
N-(2-fluorophenyl)-5-(1H-indol-3-yl)-3,6-dihydro-1,3,4-thiadiazin-2-imine
CID 135512224
3-[[4-[(2-fluorophenyl)methyl]piperazine-1,4-diium-1-yl]methyl]-1H-indole
CID 5053632
2-(1H-indol-3-yl)-5-methyl-1,3,4-oxadiazole
CID 135876288

Frequently Asked Questions

What is the IUPAC name of 3-(8-fluoro-2H-chromen-4-yl)-1H-indole?
The IUPAC name of 3-(8-fluoro-2H-chromen-4-yl)-1H-indole (CID 141330389) is 3-(8-fluoro-2H-chromen-4-yl)-1H-indole.
What is the SMILES notation for 3-(8-fluoro-2H-chromen-4-yl)-1H-indole?
The canonical SMILES for 3-(8-fluoro-2H-chromen-4-yl)-1H-indole is Fc1cccc2c1OCC=C2c1c[nH]c2ccccc12.
What is the InChIKey of 3-(8-fluoro-2H-chromen-4-yl)-1H-indole?
The InChIKey is NUJKEFWOIQLVGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12FNO/c18-15-6-3-5-13-11(8-9-20-17(13)15)14-10-19-16-7-2-1-4-12(14)16/h1-8,10,19H,9H2.
What are the key properties of 3-(8-fluoro-2H-chromen-4-yl)-1H-indole?
3-(8-fluoro-2H-chromen-4-yl)-1H-indole has a molecular weight of 265.29 g/mol, XLogP of 4.13, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(8-fluoro-2H-chromen-4-yl)-1H-indole is sourced from PubChem (CID 141330389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).