3-(7-Fluoro-3-indolyl)-1-propanamine - CAS 586336-02-9

Catalog:	BB030105
Product Name:	3-(7-Fluoro-3-indolyl)-1-propanamine
CAS:	586336-02-9
Synonyms:	3-(7-fluoro-1H-indol-3-yl)-1-propanamine; 3-(7-fluoro-1H-indol-3-yl)propan-1-amine

Technical Data

Patents

Computed Properties

IUPAC Name:	3-(7-fluoro-1H-indol-3-yl)propan-1-amine
Description:	3-(7-Fluoro-3-indolyl)-1-propanamine (CAS# 586336-02-9 ) is a useful research chemical.
Molecular Weight:	192.23
Molecular Formula:	C11H13FN2
Canonical SMILES:	C1=CC2=C(C(=C1)F)NC=C2CCCN
InChI:	InChI=1S/C11H13FN2/c12-10-5-1-4-9-8(3-2-6-13)7-14-11(9)10/h1,4-5,7,14H,2-3,6,13H2
InChI Key:	OOYDQQMBWSRGBX-UHFFFAOYSA-N
LogP:	2.89860

Publication Number	Title	Priority Date
CA-2497214-A1	Antidepressant indolealkyl derivatives of heterocycle-fused benzodioxan methylamines	20020912
CN-100358898-C	Antidepressant indolealkyl derivatives of heterocycle-fused benzodioxan methylamines	20020912
CN-101143867-A	Antidepressant indolealkyl derivatves of heterocyclefused benzodioxan methylamines	20020912
CN-1701075-A	Antidepressant indolealkyl derivatives of heterocycle-fused benzodioxan methylamines	20020912
DE-60315843-T2	ANTIDEPRESSIVE INDOLALKYL DERIVATIVES OF HETEROCYCLIC-CONDENSED BENZODIOXANETHYLAMINES	20020912

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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:	192.10627659
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	192.10627659
Rotatable Bond Count:	3
Topological Polar Surface Area:	41.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.8