5-Methoxy-N-methyl-N-(1-methylethyl)-a-oxo-1H-indole-3-acetamide - CAS 850032-61-0

Catalog:	BB060028
Product Name:	5-Methoxy-N-methyl-N-(1-methylethyl)-a-oxo-1H-indole-3-acetamide
CAS:	850032-61-0
Synonyms:	2-(5-Methoxy-1H-indol-3-yl)-N-methyl-2-oxo-N-(propan-2-yl)acetamide

Technical Data

IUPAC Name:	2-(5-methoxy-1H-indol-3-yl)-N-methyl-2-oxo-N-propan-2-ylacetamide
Description:	5-Methoxy-N-methyl-N-(1-methylethyl)-a-oxo-1H-indole-3-acetamide is an intermediate used in the synthesis of 5-Methoxy-N-methyl-N-isopropyl Tryptamine (M271680), which is a psychedelic tryptamine related to N-methyl-N-isopropyltryptamine. 5-Methoxy MiPT potently inhibits the re-uptake of the monoamines serotonin and norepinephrine but does not affect dopamine re-uptake. 5-Methoxy MiPT has no effect on the release of monoamines from rat brain synaptosomes. This product is intended for forensic and research applications.
Molecular Weight:	274.32
Molecular Formula:	C15H18N2O3
Canonical SMILES:	CC(C)N(C)C(=O)C(=O)C1=CNC2=C1C=C(C=C2)OC
InChI:	InChI=1S/C15H18N2O3/c1-9(2)17(3)15(19)14(18)12-8-16-13-6-5-10(20-4)7-11(12)13/h5-9,16H,1-4H3
InChI Key:	QXKXLJSLTUZBHT-UHFFFAOYSA-N
Melting Point:	>196°C (dec.)
Solubility:	DMSO (Slightly), THF (Slightly)
Appearance:	Pale Beige to Pale Brown Solid
Storage:	RT°C
References:	Katagi, M., et al. Jpn. J. Forensic Toxicol., 20, 303 (2002), Meatherall, R., et al. J. Anal. Toxicol., 27, 313 (2003), Wilson, J., et al. Forensic Sci. Int., 148, 31 (2005), Kamata, T., et al. Drug Metab. Dispos., 34, 281 (2006),.

Complexity:	383
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	274.13174244
Formal Charge:	0
Heavy Atom Count:	20
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	274.13174244
Rotatable Bond Count:	4
Topological Polar Surface Area:	62.4Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.2