2-(2,4-difluorophenyl)-5-fluoro-1H-indole

C14H8F3N — CID 131887083

IUPAC2-(2,4-difluorophenyl)-5-fluoro-1H-indole
SMILESFc1ccc(-c2cc3cc(F)ccc3[nH]2)c(F)c1
InChIInChI=1S/C14H8F3N/c15-9-2-4-13-8(5-9)6-14(18-13)11-3-1-10(16)7-12(11)17/h1-7,18H
InChIKeyCPLRIMZAFRDXNQ-UHFFFAOYSA-N
MW247.22 g/mol
LogP4.25
Rot. Bonds1

About 2-(2,4-difluorophenyl)-5-fluoro-1H-indole

2-(2,4-difluorophenyl)-5-fluoro-1H-indole (PubChem CID 131887083) has the molecular formula C14H8F3N and a molecular weight of 247.22 g/mol. Its IUPAC name is 2-(2,4-difluorophenyl)-5-fluoro-1H-indole.

Molecular Properties

Compound Name2-(2,4-difluorophenyl)-5-fluoro-1H-indole
PubChem CID131887083
Molecular FormulaC14H8F3N
Molecular Weight247.22 g/mol
Exact Mass247.06
IUPAC Name2-(2,4-difluorophenyl)-5-fluoro-1H-indole
SMILESFc1ccc(-c2cc3cc(F)ccc3[nH]2)c(F)c1
InChIInChI=1S/C14H8F3N/c15-9-2-4-13-8(5-9)6-14(18-13)11-3-1-10(16)7-12(11)17/h1-7,18H
InChIKeyCPLRIMZAFRDXNQ-UHFFFAOYSA-N
XLogP4.25
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.22
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

2-(2-bromophenyl)-5-fluoro-1H-indole
CID 131887074
4-(5-fluoro-1H-indol-2-yl)furan-3-carboxylic acid
CID 82385331
5-(5-fluoro-1H-indol-2-yl)-1H-pyrazol-3-amine
CID 136985649
2-bromo-5-fluoro-1H-indole
CID 84680101
5,10,15,20-tetrakis(2,4-difluorophenyl)-21,22-dihydroporphyrin
CID 10327777
6-chloro-2-(5-fluoro-1H-indol-2-yl)pyridin-3-ol
CID 90333492
2-(5-fluoro-1H-indol-2-yl)-4,5-dihydro-1,3-oxazole
CID 145057906
1-(2,4-difluorophenyl)-3-[4-(5-fluoro-1H-indol-2-yl)phenyl]urea
CID 46381076
5-(2,4-difluorophenyl)-1H-indole
CID 10176960
2-[(4R)-2-(5-fluoro-1H-indol-2-yl)-4,5-dihydro-1,3-thiazol-4-yl]ethanamine
CID 141361859
1-(2,4-difluorophenyl)-2,3,4-trifluorobenzene
CID 90766512
2-(5-fluoro-2-methoxyphenyl)-1H-indole
CID 82049249

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-difluorophenyl)-5-fluoro-1H-indole?
The IUPAC name of 2-(2,4-difluorophenyl)-5-fluoro-1H-indole (CID 131887083) is 2-(2,4-difluorophenyl)-5-fluoro-1H-indole.
What is the SMILES notation for 2-(2,4-difluorophenyl)-5-fluoro-1H-indole?
The canonical SMILES for 2-(2,4-difluorophenyl)-5-fluoro-1H-indole is Fc1ccc(-c2cc3cc(F)ccc3[nH]2)c(F)c1.
What is the InChIKey of 2-(2,4-difluorophenyl)-5-fluoro-1H-indole?
The InChIKey is CPLRIMZAFRDXNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8F3N/c15-9-2-4-13-8(5-9)6-14(18-13)11-3-1-10(16)7-12(11)17/h1-7,18H.
What are the key properties of 2-(2,4-difluorophenyl)-5-fluoro-1H-indole?
2-(2,4-difluorophenyl)-5-fluoro-1H-indole has a molecular weight of 247.22 g/mol, XLogP of 4.25, 1 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-difluorophenyl)-5-fluoro-1H-indole is sourced from PubChem (CID 131887083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).