Basic information
- CAS
3143-97-3- Standard SMILES
COc1ccc2[nH]c(C)c(CCN)c2c1- InChIKey
TYAPSMFCSAKSOR-UHFFFAOYSA-N- Molecular formula
- C12H16N2O
- Average molar mass
- 204.27 g/mol
- Monoisotopic mass
- 204.12626314
Names & identifiers
- Preferred name
- 2-(5-Methoxy-2-methyl-1H-indol-3-yl)ethanamine
- IUPAC
- 2-(5-methoxy-2-methyl-1H-indol-3-yl)ethanamine
- English name
- 2-(5-Methoxy-2-Methyl-1H-indol-3-yl)ethanaMine
- Molecular formula
- C12H16N2O
- Molecular weight
- 204.27
Names & synonyms
3143-97-32-(5-Methoxy-2-methyl-1H-indol-3-yl)ethanamine2-(5-Methoxy-2-methyl-1H-indol-3-yl)-ethylamine2-Methyl-5-methoxytryptamine2-(5-methoxy-2-methyl-1H-indol-3-yl)ethan-1-amineCHEMBL2688002-(5-methoxy-2-methylindol-3-yl)ethylamine1H-Indole-3-ethanamine, 5-methoxy-2-methyl-Oprea1_427162SCHEMBL4244966DTXSID801363441BDBM50014946
Show more names
PDSP1_000390PDSP2_000388SBB012637STK137453AKOS001729596SB365365-methoxy-2-methylindole-3-ethyl amineST038835
Database identifiers
- CAS
3143-97-3- PubChem CID
- 52899
- DTXSID
DTXSID801363441- ChEMBL
CHEMBL268800- Nikkaji
- J45.388I
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 51 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 210
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers6 total
杰达维（上海）医药科技发展有限公司/J & W PharmLab021-64340559 · [email protected]
成都同创源医药科技有限公司028-83379370 13880556291 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
上海万千化工有限公司18796480002 18796480002 · [email protected]
上海旺珐化工科技有限公司（安徽珐诺伊医药科技有限公司）13918479294 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
4 records
Compound notes
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