2-(4-bromo-1-propan-2-yl-2,3-dihydroindol-2-yl)ethanamine

C13H19BrN2 — CID 117198825

IUPAC2-(4-bromo-1-propan-2-yl-2,3-dihydroindol-2-yl)ethanamine
SMILESCC(C)N1c2cccc(Br)c2CC1CCN
InChIInChI=1S/C13H19BrN2/c1-9(2)16-10(6-7-15)8-11-12(14)4-3-5-13(11)16/h3-5,9-10H,6-8,15H2,1-2H3
InChIKeyWUEAUHDGEPVNTL-UHFFFAOYSA-N
MW283.21 g/mol
LogP2.94
Rot. Bonds3

About 2-(4-bromo-1-propan-2-yl-2,3-dihydroindol-2-yl)ethanamine

2-(4-bromo-1-propan-2-yl-2,3-dihydroindol-2-yl)ethanamine (PubChem CID 117198825) has the molecular formula C13H19BrN2 and a molecular weight of 283.21 g/mol. Its IUPAC name is 2-(4-bromo-1-propan-2-yl-2,3-dihydroindol-2-yl)ethanamine.

Molecular Properties

Compound Name2-(4-bromo-1-propan-2-yl-2,3-dihydroindol-2-yl)ethanamine
PubChem CID117198825
Molecular FormulaC13H19BrN2
Molecular Weight283.21 g/mol
Exact Mass282.07
IUPAC Name2-(4-bromo-1-propan-2-yl-2,3-dihydroindol-2-yl)ethanamine
SMILESCC(C)N1c2cccc(Br)c2CC1CCN
InChIInChI=1S/C13H19BrN2/c1-9(2)16-10(6-7-15)8-11-12(14)4-3-5-13(11)16/h3-5,9-10H,6-8,15H2,1-2H3
InChIKeyWUEAUHDGEPVNTL-UHFFFAOYSA-N
XLogP2.94
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.21
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-bromo-1-propan-2-yl-2,3-dihydroindol-2-yl)-2-methylpropan-2-ol
CID 117198770
1-(4-bromo-1-propan-2-yl-2,3-dihydroindol-2-yl)ethanamine
CID 117198803
1-(4-bromo-1-methyl-2,3-dihydroindol-2-yl)propan-2-ol
CID 117198613
2-(4-bromo-2-methyl-2,3-dihydroindol-1-yl)ethanamine
CID 118050177
2-(1-ethyl-4-fluoro-2,3-dihydroindol-2-yl)ethanamine
CID 117198805
3-(4-bromo-1-methyl-2,3-dihydroindol-2-yl)-2-methylpropanoic acid
CID 117198727
3-(5-bromo-1-propan-2-yl-2,3-dihydroindol-2-yl)propan-1-amine
CID 117201227
1-(4-methyl-1-propan-2-yl-2,3-dihydroindol-2-yl)propan-2-ol
CID 117198329
2-(methylaminomethyl)-1-propan-2-yl-2,3-dihydroindol-4-ol
CID 117199159
3-(4-bromo-1-ethyl-2,3-dihydroindol-2-yl)propanoic acid
CID 117198876
1-(4-bromo-1-ethyl-2,3-dihydroindol-2-yl)ethanol
CID 117198761
2-[4-(2-bromophenyl)-1,5,5-trimethylpiperazin-2-yl]ethanamine
CID 84607203

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromo-1-propan-2-yl-2,3-dihydroindol-2-yl)ethanamine?
The IUPAC name of 2-(4-bromo-1-propan-2-yl-2,3-dihydroindol-2-yl)ethanamine (CID 117198825) is 2-(4-bromo-1-propan-2-yl-2,3-dihydroindol-2-yl)ethanamine.
What is the SMILES notation for 2-(4-bromo-1-propan-2-yl-2,3-dihydroindol-2-yl)ethanamine?
The canonical SMILES for 2-(4-bromo-1-propan-2-yl-2,3-dihydroindol-2-yl)ethanamine is CC(C)N1c2cccc(Br)c2CC1CCN.
What is the InChIKey of 2-(4-bromo-1-propan-2-yl-2,3-dihydroindol-2-yl)ethanamine?
The InChIKey is WUEAUHDGEPVNTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19BrN2/c1-9(2)16-10(6-7-15)8-11-12(14)4-3-5-13(11)16/h3-5,9-10H,6-8,15H2,1-2H3.
What are the key properties of 2-(4-bromo-1-propan-2-yl-2,3-dihydroindol-2-yl)ethanamine?
2-(4-bromo-1-propan-2-yl-2,3-dihydroindol-2-yl)ethanamine has a molecular weight of 283.21 g/mol, XLogP of 2.94, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromo-1-propan-2-yl-2,3-dihydroindol-2-yl)ethanamine is sourced from PubChem (CID 117198825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).