2-(7-bromo-2,3-dihydro-1H-inden-1-yl)ethanamine

C11H14BrN — CID 83843148

IUPAC2-(7-bromo-2,3-dihydro-1H-inden-1-yl)ethanamine
SMILESNCCC1CCc2cccc(Br)c21
InChIInChI=1S/C11H14BrN/c12-10-3-1-2-8-4-5-9(6-7-13)11(8)10/h1-3,9H,4-7,13H2
InChIKeyBLESBGHRDGCVSB-UHFFFAOYSA-N
MW240.14 g/mol
LogP2.83
Rot. Bonds2

About 2-(7-bromo-2,3-dihydro-1H-inden-1-yl)ethanamine

2-(7-bromo-2,3-dihydro-1H-inden-1-yl)ethanamine (PubChem CID 83843148) has the molecular formula C11H14BrN and a molecular weight of 240.14 g/mol. Its IUPAC name is 2-(7-bromo-2,3-dihydro-1H-inden-1-yl)ethanamine.

Molecular Properties

Compound Name2-(7-bromo-2,3-dihydro-1H-inden-1-yl)ethanamine
PubChem CID83843148
Molecular FormulaC11H14BrN
Molecular Weight240.14 g/mol
Exact Mass239.03
IUPAC Name2-(7-bromo-2,3-dihydro-1H-inden-1-yl)ethanamine
SMILESNCCC1CCc2cccc(Br)c21
InChIInChI=1S/C11H14BrN/c12-10-3-1-2-8-4-5-9(6-7-13)11(8)10/h1-3,9H,4-7,13H2
InChIKeyBLESBGHRDGCVSB-UHFFFAOYSA-N
XLogP2.83
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.14
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-(2-aminoethyl)-N,N-dimethyl-2,3-dihydro-1H-inden-4-amine
CID 112709075
2-(7-pyrrolidin-1-yl-2,3-dihydro-1H-inden-1-yl)ethanamine
CID 105422248
(5-bromo-7-bicyclo[4.2.0]octa-1(6),2,4-trienyl)methanamine
CID 105465700
2-(8-bromo-1,2,3,4-tetrahydroquinolin-2-yl)ethanamine
CID 84635560
2-(8-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine
CID 83829383
(1R)-8-bromo-1,2,3,4-tetrahydronaphthalen-1-amine
CID 86328574
(1S)-7-bromo-2,3-dihydro-1H-inden-1-ol
CID 129246818
4-bromo-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 130067141
2-(4-bromo-2,3-dihydro-1-benzothiophen-3-yl)ethanamine
CID 117199847
(5S,6R)-6-amino-4-bromo-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-ol
CID 51600913
3-(aminomethyl)-N-methyl-2,3-dihydro-1H-inden-4-amine
CID 112708686
7-fluoro-2,3-dihydro-1H-inden-1-amine
CID 58440160

Frequently Asked Questions

What is the IUPAC name of 2-(7-bromo-2,3-dihydro-1H-inden-1-yl)ethanamine?
The IUPAC name of 2-(7-bromo-2,3-dihydro-1H-inden-1-yl)ethanamine (CID 83843148) is 2-(7-bromo-2,3-dihydro-1H-inden-1-yl)ethanamine.
What is the SMILES notation for 2-(7-bromo-2,3-dihydro-1H-inden-1-yl)ethanamine?
The canonical SMILES for 2-(7-bromo-2,3-dihydro-1H-inden-1-yl)ethanamine is NCCC1CCc2cccc(Br)c21.
What is the InChIKey of 2-(7-bromo-2,3-dihydro-1H-inden-1-yl)ethanamine?
The InChIKey is BLESBGHRDGCVSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14BrN/c12-10-3-1-2-8-4-5-9(6-7-13)11(8)10/h1-3,9H,4-7,13H2.
What are the key properties of 2-(7-bromo-2,3-dihydro-1H-inden-1-yl)ethanamine?
2-(7-bromo-2,3-dihydro-1H-inden-1-yl)ethanamine has a molecular weight of 240.14 g/mol, XLogP of 2.83, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-bromo-2,3-dihydro-1H-inden-1-yl)ethanamine is sourced from PubChem (CID 83843148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).