2-(6-thiophen-2-yl-1H-indol-3-yl)ethanamine

C14H14N2S — CID 82293447

IUPAC2-(6-thiophen-2-yl-1H-indol-3-yl)ethanamine
SMILESNCCc1c[nH]c2cc(-c3cccs3)ccc12
InChIInChI=1S/C14H14N2S/c15-6-5-11-9-16-13-8-10(3-4-12(11)13)14-2-1-7-17-14/h1-4,7-9,16H,5-6,15H2
InChIKeyAAIITMSDLOBYKV-UHFFFAOYSA-N
MW242.35 g/mol
LogP3.40
Rot. Bonds3

About 2-(6-thiophen-2-yl-1H-indol-3-yl)ethanamine

2-(6-thiophen-2-yl-1H-indol-3-yl)ethanamine (PubChem CID 82293447) has the molecular formula C14H14N2S and a molecular weight of 242.35 g/mol. Its IUPAC name is 2-(6-thiophen-2-yl-1H-indol-3-yl)ethanamine.

Molecular Properties

Compound Name2-(6-thiophen-2-yl-1H-indol-3-yl)ethanamine
PubChem CID82293447
Molecular FormulaC14H14N2S
Molecular Weight242.35 g/mol
Exact Mass242.09
IUPAC Name2-(6-thiophen-2-yl-1H-indol-3-yl)ethanamine
SMILESNCCc1c[nH]c2cc(-c3cccs3)ccc12
InChIInChI=1S/C14H14N2S/c15-6-5-11-9-16-13-8-10(3-4-12(11)13)14-2-1-7-17-14/h1-4,7-9,16H,5-6,15H2
InChIKeyAAIITMSDLOBYKV-UHFFFAOYSA-N
XLogP3.40
TPSA41.81 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.35
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(5-thiophen-2-yl-1H-indol-3-yl)ethanamine
CID 10198700
3-ethyl-5-thiophen-2-yl-1H-indole;N-methylmethanamine
CID 19078392
2-(6-fluoro-1H-indol-3-yl)ethanamine;hydron
CID 121393685
2-[6-(trifluoromethoxy)-1H-indol-3-yl]ethanamine
CID 34176010
3-[4-(4-thiophen-2-ylpyridin-1-ium-1-yl)butyl]-1H-indole bromide
CID 19848937
3-[2-[4-(3-thiophen-2-ylphenoxy)piperidin-1-yl]ethyl]-1H-indole
CID 24733645
2-(20-thiophen-2-yl-7-hexacyclo[12.12.0.02,11.05,10.015,24.018,23]hexacosa-1(14),2(11),3,5(10),6,8,12,15(24),16,18(23),19,21,25-tridecaenyl)thiophene
CID 58411506
2-[1-(benzenesulfinyl)-5-thiophen-2-ylindol-3-yl]ethanamine;hydrochloride
CID 70076732
9-methyl-2,7-dithiophen-2-ylcarbazole
CID 102153776
2-(1H-indol-3-yl)ethanamine;methyl hypoiodite
CID 143451156
3-[4-(4-thiophen-2-yl-1,2,3,6-tetrahydropyridin-2-yl)butyl]-1H-indol-6-ol
CID 19848882
N-[2-(6-chloro-1H-indol-3-yl)ethyl]thiophene-2-sulfonamide
CID 113083889

Frequently Asked Questions

What is the IUPAC name of 2-(6-thiophen-2-yl-1H-indol-3-yl)ethanamine?
The IUPAC name of 2-(6-thiophen-2-yl-1H-indol-3-yl)ethanamine (CID 82293447) is 2-(6-thiophen-2-yl-1H-indol-3-yl)ethanamine.
What is the SMILES notation for 2-(6-thiophen-2-yl-1H-indol-3-yl)ethanamine?
The canonical SMILES for 2-(6-thiophen-2-yl-1H-indol-3-yl)ethanamine is NCCc1c[nH]c2cc(-c3cccs3)ccc12.
What is the InChIKey of 2-(6-thiophen-2-yl-1H-indol-3-yl)ethanamine?
The InChIKey is AAIITMSDLOBYKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2S/c15-6-5-11-9-16-13-8-10(3-4-12(11)13)14-2-1-7-17-14/h1-4,7-9,16H,5-6,15H2.
What are the key properties of 2-(6-thiophen-2-yl-1H-indol-3-yl)ethanamine?
2-(6-thiophen-2-yl-1H-indol-3-yl)ethanamine has a molecular weight of 242.35 g/mol, XLogP of 3.40, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-thiophen-2-yl-1H-indol-3-yl)ethanamine is sourced from PubChem (CID 82293447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).