5-Methoxy-N,N-bis(1-methylethyl)-α-oxo-1H-indole-3-acetamide - CAS 2426-22-4
Catalog: |
BB060204 |
Product Name: |
5-Methoxy-N,N-bis(1-methylethyl)-α-oxo-1H-indole-3-acetamide |
CAS: |
2426-22-4 |
Synonyms: |
N,N-Diisopropyl-5-methoxyindole-3-glyoxylamide; 5-Methoxy-N,N-bis(1-methylethyl)-α-oxo-1H-indole-3-acetamide |
IUPAC Name: | 2-(5-methoxy-1H-indol-3-yl)-2-oxo-N,N-di(propan-2-yl)acetamide |
Description: | 5-Methoxy-N,N-bis(1-methylethyl)-α-oxo-1H-indole-3-acetamide is an intermediate in the synthesis of 5-Methoxy-N,N-diisopropyltryptamine (M262470), a psychoative tryptamine analog. |
Molecular Weight: | 302.37 |
Molecular Formula: | C17H22N2O3 |
Canonical SMILES: | CC(C)N(C(C)C)C(=O)C(=O)C1=CNC2=C1C=C(C=C2)OC |
InChI: | InChI=1S/C17H22N2O3/c1-10(2)19(11(3)4)17(21)16(20)14-9-18-15-7-6-12(22-5)8-13(14)15/h6-11,18H,1-5H3 |
InChI Key: | CKRKISNXFPSRFT-UHFFFAOYSA-N |
Melting Point: | >215°C (dec.) |
Solubility: | Chloroform (Slightly), Methanol (Slightly) |
Appearance: | Light Beige to Yellow Solid |
Storage: | -20°C Freezer |
References: | Brandt, S. D., et al. J. Label. Comp. Radiopharma., 51, 423 (2008). |
Complexity: | 414 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 302.16304257 |
Formal Charge: | 0 |
Heavy Atom Count: | 22 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 302.16304257 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 62.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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