2-(2-fluorophenyl)-2-(1H-indol-3-yl)ethanamine

C16H15FN2 — CID 82021241

IUPAC2-(2-fluorophenyl)-2-(1H-indol-3-yl)ethanamine
SMILESNCC(c1ccccc1F)c1c[nH]c2ccccc12
InChIInChI=1S/C16H15FN2/c17-15-7-3-1-5-11(15)13(9-18)14-10-19-16-8-4-2-6-12(14)16/h1-8,10,13,19H,9,18H2
InChIKeyAVAIJLMSUTVPPF-UHFFFAOYSA-N
MW254.31 g/mol
LogP3.40
Rot. Bonds3

About 2-(2-fluorophenyl)-2-(1H-indol-3-yl)ethanamine

2-(2-fluorophenyl)-2-(1H-indol-3-yl)ethanamine (PubChem CID 82021241) has the molecular formula C16H15FN2 and a molecular weight of 254.31 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-2-(1H-indol-3-yl)ethanamine.

Molecular Properties

Compound Name2-(2-fluorophenyl)-2-(1H-indol-3-yl)ethanamine
PubChem CID82021241
Molecular FormulaC16H15FN2
Molecular Weight254.31 g/mol
Exact Mass254.12
IUPAC Name2-(2-fluorophenyl)-2-(1H-indol-3-yl)ethanamine
SMILESNCC(c1ccccc1F)c1c[nH]c2ccccc12
InChIInChI=1S/C16H15FN2/c17-15-7-3-1-5-11(15)13(9-18)14-10-19-16-8-4-2-6-12(14)16/h1-8,10,13,19H,9,18H2
InChIKeyAVAIJLMSUTVPPF-UHFFFAOYSA-N
XLogP3.40
TPSA41.81 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.31
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

2-(1H-indol-3-yl)-2-phenylethanamine
CID 609935
2-(1H-indol-3-yl)propan-1-amine
CID 6452095
2-(1H-indol-3-yl)propan-1-amine;hydrochloride
CID 11970278
3-amino-1-(1H-indol-3-yl)propan-1-ol
CID 82281300
(1S)-1-(1H-indol-3-yl)pentane-1,5-diamine
CID 171217468
(3R)-3-(2-chlorophenyl)-3-(1H-indol-3-yl)propan-1-ol
CID 45101575
3-(4-fluorophenyl)-3-(1H-indol-3-yl)propanoic acid
CID 3550541
2,6-difluoro-N-[2-(1H-indol-3-yl)-2-phenylethyl]benzamide
CID 46553423
N-[(2-fluorophenyl)-(1H-indol-3-yl)methyl]pyridin-2-amine
CID 66573206
2-(3-fluorophenyl)-2-(1H-indol-3-yl)ethanol
CID 175098776
(1R)-2,2,2-trifluoro-1-(1H-indol-3-yl)ethanamine
CID 42553559
2-(4-chlorophenyl)-2-(2-fluorophenyl)ethanamine
CID 82023285

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-2-(1H-indol-3-yl)ethanamine?
The IUPAC name of 2-(2-fluorophenyl)-2-(1H-indol-3-yl)ethanamine (CID 82021241) is 2-(2-fluorophenyl)-2-(1H-indol-3-yl)ethanamine.
What is the SMILES notation for 2-(2-fluorophenyl)-2-(1H-indol-3-yl)ethanamine?
The canonical SMILES for 2-(2-fluorophenyl)-2-(1H-indol-3-yl)ethanamine is NCC(c1ccccc1F)c1c[nH]c2ccccc12.
What is the InChIKey of 2-(2-fluorophenyl)-2-(1H-indol-3-yl)ethanamine?
The InChIKey is AVAIJLMSUTVPPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FN2/c17-15-7-3-1-5-11(15)13(9-18)14-10-19-16-8-4-2-6-12(14)16/h1-8,10,13,19H,9,18H2.
What are the key properties of 2-(2-fluorophenyl)-2-(1H-indol-3-yl)ethanamine?
2-(2-fluorophenyl)-2-(1H-indol-3-yl)ethanamine has a molecular weight of 254.31 g/mol, XLogP of 3.40, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-2-(1H-indol-3-yl)ethanamine is sourced from PubChem (CID 82021241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).