5-[2-(4-fluorophenyl)ethyl]-3H-indole

C16H14FN — CID 58480633

IUPAC5-[2-(4-fluorophenyl)ethyl]-3H-indole
SMILESFc1ccc(CCc2ccc3c(c2)CC=N3)cc1
InChIInChI=1S/C16H14FN/c17-15-6-3-12(4-7-15)1-2-13-5-8-16-14(11-13)9-10-18-16/h3-8,10-11H,1-2,9H2
InChIKeyNSHYWSMZNRHYEB-UHFFFAOYSA-N
MW239.29 g/mol
LogP3.87
Rot. Bonds3

About 5-[2-(4-fluorophenyl)ethyl]-3H-indole

5-[2-(4-fluorophenyl)ethyl]-3H-indole (PubChem CID 58480633) has the molecular formula C16H14FN and a molecular weight of 239.29 g/mol. Its IUPAC name is 5-[2-(4-fluorophenyl)ethyl]-3H-indole.

Molecular Properties

Compound Name5-[2-(4-fluorophenyl)ethyl]-3H-indole
PubChem CID58480633
Molecular FormulaC16H14FN
Molecular Weight239.29 g/mol
Exact Mass239.11
IUPAC Name5-[2-(4-fluorophenyl)ethyl]-3H-indole
SMILESFc1ccc(CCc2ccc3c(c2)CC=N3)cc1
InChIInChI=1S/C16H14FN/c17-15-6-3-12(4-7-15)1-2-13-5-8-16-14(11-13)9-10-18-16/h3-8,10-11H,1-2,9H2
InChIKeyNSHYWSMZNRHYEB-UHFFFAOYSA-N
XLogP3.87
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.29
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

5-(4-fluorophenoxy)-3H-indole
CID 158181803
1-fluoro-4-methylbenzene;1-fluoro-4-[2-(4-methylphenyl)ethyl]benzene
CID 144561335
2-(4-fluorophenyl)-3-(3H-indol-5-yl)-1,3-thiazolidin-4-one
CID 58229147
6-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]-1,2,3,4-tetrahydronaphthalene
CID 19914431
1-fluoro-4-propylbenzene
CID 2737505
2-(4-fluorophenyl)ethylazanium iodide
CID 155288874
lithium 2-(4-fluorophenyl)ethanolate
CID 101196561
3-(4-fluorophenyl)-N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]propanamide
CID 110788471
sodium 1-ethyl-4-fluorobenzene
CID 174390986
1-fluoro-4-[4-(2-iodoethyl)phenyl]benzene
CID 66577934
3-[2-(4-fluorophenyl)ethoxy]azetidine
CID 115070498
1-[2-(4-fluorophenyl)ethyl]cyclopropan-1-amine
CID 67420694

Frequently Asked Questions

What is the IUPAC name of 5-[2-(4-fluorophenyl)ethyl]-3H-indole?
The IUPAC name of 5-[2-(4-fluorophenyl)ethyl]-3H-indole (CID 58480633) is 5-[2-(4-fluorophenyl)ethyl]-3H-indole.
What is the SMILES notation for 5-[2-(4-fluorophenyl)ethyl]-3H-indole?
The canonical SMILES for 5-[2-(4-fluorophenyl)ethyl]-3H-indole is Fc1ccc(CCc2ccc3c(c2)CC=N3)cc1.
What is the InChIKey of 5-[2-(4-fluorophenyl)ethyl]-3H-indole?
The InChIKey is NSHYWSMZNRHYEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FN/c17-15-6-3-12(4-7-15)1-2-13-5-8-16-14(11-13)9-10-18-16/h3-8,10-11H,1-2,9H2.
What are the key properties of 5-[2-(4-fluorophenyl)ethyl]-3H-indole?
5-[2-(4-fluorophenyl)ethyl]-3H-indole has a molecular weight of 239.29 g/mol, XLogP of 3.87, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(4-fluorophenyl)ethyl]-3H-indole is sourced from PubChem (CID 58480633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).