2-[5-(2-fluoroethoxy)-1H-indol-3-yl]ethanamine

C12H15FN2O — CID 71510843

IUPAC2-[5-(2-fluoroethoxy)-1H-indol-3-yl]ethanamine
SMILESNCCc1c[nH]c2ccc(OCCF)cc12
InChIInChI=1S/C12H15FN2O/c13-4-6-16-10-1-2-12-11(7-10)9(3-5-14)8-15-12/h1-2,7-8,15H,3-6,14H2
InChIKeyOYROFHOTWOOYML-UHFFFAOYSA-N
MW222.26 g/mol
LogP2.02
Rot. Bonds5

About 2-[5-(2-fluoroethoxy)-1H-indol-3-yl]ethanamine

2-[5-(2-fluoroethoxy)-1H-indol-3-yl]ethanamine (PubChem CID 71510843) has the molecular formula C12H15FN2O and a molecular weight of 222.26 g/mol. Its IUPAC name is 2-[5-(2-fluoroethoxy)-1H-indol-3-yl]ethanamine.

Molecular Properties

Compound Name2-[5-(2-fluoroethoxy)-1H-indol-3-yl]ethanamine
PubChem CID71510843
Molecular FormulaC12H15FN2O
Molecular Weight222.26 g/mol
Exact Mass222.12
IUPAC Name2-[5-(2-fluoroethoxy)-1H-indol-3-yl]ethanamine
SMILESNCCc1c[nH]c2ccc(OCCF)cc12
InChIInChI=1S/C12H15FN2O/c13-4-6-16-10-1-2-12-11(7-10)9(3-5-14)8-15-12/h1-2,7-8,15H,3-6,14H2
InChIKeyOYROFHOTWOOYML-UHFFFAOYSA-N
XLogP2.02
TPSA51.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.26
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-[[3-(2-aminoethyl)-1H-indol-5-yl]oxy]pentan-1-amine
CID 15341730
2-[2-[5-(2-fluoroethoxy)-1H-indol-3-yl]ethyl]guanidine
CID 71510842
2-(5-octoxy-1H-indol-3-yl)ethanamine
CID 10613373
2-(5-pentoxy-1H-indol-3-yl)ethanamine
CID 10848041
2-[5-(6-ethoxyhexoxy)-1H-indol-3-yl]ethanamine
CID 15342178
5-[5-(2-fluoroethoxy)-1H-indol-3-yl]pentan-2-imine
CID 159935629
2-[5-[(4-iodophenyl)methoxy]-1H-indol-3-yl]ethanamine
CID 154204464
(2S)-2-amino-3-[5-(2-fluoroethoxy)-1H-indol-3-yl]propanoic acid
CID 91265595
2-[5-(3,7-dimethyloctoxy)-1H-indol-3-yl]ethanamine;hydrochloride
CID 134155855
N-[6-[[3-(2-aminoethyl)-1H-indol-5-yl]oxy]hexyl]methanesulfonamide;hydrochloride
CID 22097965
bis[3-(2-aminoethyl)-1H-indol-5-yl] hexanedioate
CID 57477029
2-[4-[[3-(2-aminoethyl)-1H-indol-5-yl]oxy]butyl]isoindole-1,3-dione;hydrochloride
CID 19029941

Frequently Asked Questions

What is the IUPAC name of 2-[5-(2-fluoroethoxy)-1H-indol-3-yl]ethanamine?
The IUPAC name of 2-[5-(2-fluoroethoxy)-1H-indol-3-yl]ethanamine (CID 71510843) is 2-[5-(2-fluoroethoxy)-1H-indol-3-yl]ethanamine.
What is the SMILES notation for 2-[5-(2-fluoroethoxy)-1H-indol-3-yl]ethanamine?
The canonical SMILES for 2-[5-(2-fluoroethoxy)-1H-indol-3-yl]ethanamine is NCCc1c[nH]c2ccc(OCCF)cc12.
What is the InChIKey of 2-[5-(2-fluoroethoxy)-1H-indol-3-yl]ethanamine?
The InChIKey is OYROFHOTWOOYML-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FN2O/c13-4-6-16-10-1-2-12-11(7-10)9(3-5-14)8-15-12/h1-2,7-8,15H,3-6,14H2.
What are the key properties of 2-[5-(2-fluoroethoxy)-1H-indol-3-yl]ethanamine?
2-[5-(2-fluoroethoxy)-1H-indol-3-yl]ethanamine has a molecular weight of 222.26 g/mol, XLogP of 2.02, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(2-fluoroethoxy)-1H-indol-3-yl]ethanamine is sourced from PubChem (CID 71510843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).