2-(5-bromothiophen-2-yl)-2-(2-methyl-2,3-dihydroindol-1-yl)ethanamine

C15H17BrN2S — CID 24703848

IUPAC2-(5-bromothiophen-2-yl)-2-(2-methyl-2,3-dihydroindol-1-yl)ethanamine
SMILESCC1Cc2ccccc2N1C(CN)c1ccc(Br)s1
InChIInChI=1S/C15H17BrN2S/c1-10-8-11-4-2-3-5-12(11)18(10)13(9-17)14-6-7-15(16)19-14/h2-7,10,13H,8-9,17H2,1H3
InChIKeyOWLPZRGSXYXDBP-UHFFFAOYSA-N
MW337.29 g/mol
LogP3.96
Rot. Bonds3

About 2-(5-bromothiophen-2-yl)-2-(2-methyl-2,3-dihydroindol-1-yl)ethanamine

2-(5-bromothiophen-2-yl)-2-(2-methyl-2,3-dihydroindol-1-yl)ethanamine (PubChem CID 24703848) has the molecular formula C15H17BrN2S and a molecular weight of 337.29 g/mol. Its IUPAC name is 2-(5-bromothiophen-2-yl)-2-(2-methyl-2,3-dihydroindol-1-yl)ethanamine.

Molecular Properties

Compound Name2-(5-bromothiophen-2-yl)-2-(2-methyl-2,3-dihydroindol-1-yl)ethanamine
PubChem CID24703848
Molecular FormulaC15H17BrN2S
Molecular Weight337.29 g/mol
Exact Mass336.03
IUPAC Name2-(5-bromothiophen-2-yl)-2-(2-methyl-2,3-dihydroindol-1-yl)ethanamine
SMILESCC1Cc2ccccc2N1C(CN)c1ccc(Br)s1
InChIInChI=1S/C15H17BrN2S/c1-10-8-11-4-2-3-5-12(11)18(10)13(9-17)14-6-7-15(16)19-14/h2-7,10,13H,8-9,17H2,1H3
InChIKeyOWLPZRGSXYXDBP-UHFFFAOYSA-N
XLogP3.96
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.29
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-bromophenyl)-2-(2-methyl-2,3-dihydroindol-1-yl)ethanamine
CID 43184711
2-cyclopentyl-2-(2-methyl-2,3-dihydroindol-1-yl)ethanamine
CID 114999984
2-(2-methyl-2,3-dihydroindol-1-yl)hexan-1-amine
CID 114993614
2-(5-ethylthiophen-2-yl)-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)ethanamine
CID 63467051
2-(5-bromothiophen-2-yl)-2-(4-ethyl-3-methylpiperazin-1-yl)ethanamine
CID 63603804
2-methyl-3-(2-methyl-2,3-dihydroindol-1-yl)propan-1-amine
CID 43367603
(3S)-N-methyl-3-[(2R)-2-methyl-2,3-dihydroindol-1-yl]-3-thiophen-2-ylpropan-1-amine
CID 137443095
2-(2-methyl-2,3-dihydroindol-1-yl)octan-1-amine
CID 43130428
2-(5-bromothiophen-2-yl)-2-(2,2-dimethylpyrrolidin-1-yl)ethanamine
CID 63216262
2-(5-bromothiophen-2-yl)-2-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)ethanamine
CID 79930781
2-(5-bromothiophen-2-yl)-2-(2-ethylmorpholin-4-yl)ethanamine
CID 43562446
2-(2-methyl-2,3-dihydroindol-1-yl)-N-propan-2-ylpropan-1-amine
CID 62425147

Frequently Asked Questions

What is the IUPAC name of 2-(5-bromothiophen-2-yl)-2-(2-methyl-2,3-dihydroindol-1-yl)ethanamine?
The IUPAC name of 2-(5-bromothiophen-2-yl)-2-(2-methyl-2,3-dihydroindol-1-yl)ethanamine (CID 24703848) is 2-(5-bromothiophen-2-yl)-2-(2-methyl-2,3-dihydroindol-1-yl)ethanamine.
What is the SMILES notation for 2-(5-bromothiophen-2-yl)-2-(2-methyl-2,3-dihydroindol-1-yl)ethanamine?
The canonical SMILES for 2-(5-bromothiophen-2-yl)-2-(2-methyl-2,3-dihydroindol-1-yl)ethanamine is CC1Cc2ccccc2N1C(CN)c1ccc(Br)s1.
What is the InChIKey of 2-(5-bromothiophen-2-yl)-2-(2-methyl-2,3-dihydroindol-1-yl)ethanamine?
The InChIKey is OWLPZRGSXYXDBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17BrN2S/c1-10-8-11-4-2-3-5-12(11)18(10)13(9-17)14-6-7-15(16)19-14/h2-7,10,13H,8-9,17H2,1H3.
What are the key properties of 2-(5-bromothiophen-2-yl)-2-(2-methyl-2,3-dihydroindol-1-yl)ethanamine?
2-(5-bromothiophen-2-yl)-2-(2-methyl-2,3-dihydroindol-1-yl)ethanamine has a molecular weight of 337.29 g/mol, XLogP of 3.96, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromothiophen-2-yl)-2-(2-methyl-2,3-dihydroindol-1-yl)ethanamine is sourced from PubChem (CID 24703848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).