5-Chloro-1H-indole-3-propanamine - CAS 54298-68-9

Catalog:	BB028590
Product Name:	5-Chloro-1H-indole-3-propanamine
CAS:	54298-68-9
Synonyms:	3-(5-chloro-1H-indol-3-yl)-1-propanamine; 3-(5-chloro-1H-indol-3-yl)propan-1-amine

Technical Data

Patents

Computed Properties

IUPAC Name:	3-(5-chloro-1H-indol-3-yl)propan-1-amine
Description:	5-Chloro-1H-indole-3-propanamine (CAS# 54298-68-9 ) is a useful research chemical.
Molecular Weight:	208.69
Molecular Formula:	C11H13ClN2
Canonical SMILES:	C1=CC2=C(C=C1Cl)C(=CN2)CCCN
InChI:	InChI=1S/C11H13ClN2/c12-9-3-4-11-10(6-9)8(7-14-11)2-1-5-13/h3-4,6-7,14H,1-2,5,13H2
InChI Key:	LHRVIXGXFXJLTO-UHFFFAOYSA-N
LogP:	3.41290

Publication Number	Title	Priority Date
KR-20210093155-A	Novel compound, preparation method thereof, and use thereof	20200117
WO-2021145729-A1	Novel compound, preparation method thereof, and use thereof	20200117
DK-2651888-T3	N - ((1H-indol-3-yl) alkyl) -4-benzyl) benzamide and N - ((1H-pyrrolo [2,3-b] pyridin-3-yl) alkyl) -4-benzyl ) benzamide derivatives as alpha-synuclein aggregation inhibitors for the treatment of neurodegenerative diseases	20101213
EP-2651887-A1	Novel compounds for the treatment of neurodegenerative diseases	20101213
EP-2651887-B1	N-(2-(5-substituted-1H-indol-3-yl)ethyl)biphenyl-4-carboxamide derivatives and related compounds as Tau-aggregation induced toxicity inhibitors for the treatment of neurodegenerative disorders	20101213

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Related Functional Groups

Indoles

[1884330-89-5]
1-Methyl-1H-indole-5-D
[2642-37-7]
Indoxyl sulfate potassium salt
[20776-45-8]
5-Benzyloxytryptamine
[61149-52-8]
Ethyl 4-methyl-7-nitro-1H-indole-2-carboxylate
[6960-46-9]
Ethyl 7-nitroindole-2-carboxylate
[15861-24-2]
Indole-5-carbonitrile

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Complexity:	186
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	208.0767261
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	208.0767261
Rotatable Bond Count:	3
Topological Polar Surface Area:	41.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.6