Basic information
- CAS
46397-90-4- Standard SMILES
CCN(CC)Cc1c[nH]c2ccccc12- InChIKey
RCGABEQHDDFFRR-UHFFFAOYSA-N- Molecular formula
- C13H18N2
- Average molar mass
- 202.3 g/mol
- Monoisotopic mass
- 202.14699858
Names & identifiers
- Preferred name
- N,N-Diethyl-1H-indole-3-methanamine
- IUPAC
- N-ethyl-N-(1H-indol-3-ylmethyl)ethanamine
Names & synonyms
46397-90-4INDOLE, 3-((DIETHYLAMINO)METHYL)-N,N-Diethyl-1H-indole-3-methanamineDTXSID10196827RefChem:1090424DTXCID50119318N-Ethyl-N-(1H-indol-3-ylmethyl)ethanamine3-((Diethylamino)methyl)indoleN-((1H-Indol-3-yl)methyl)-N-ethylethanaminediethyl[(1H-indol-3-yl)methyl]amineBRN 01604041H-Indole-3-methanamine, N,N-diethyl-
Show more names
NSC331211Cambridge id 5236785Oprea1_182998Oprea1_424489CBDivE_0085305-22-10-00026 (Beilstein Handbook Reference)MLS000104622diethyl(indol-3-ylmethyl)amine
Database identifiers
- CAS
46397-90-4- PubChem CID
- 39450
- DTXSID
DTXSID10196827- ChEMBL
CHEMBL1359979- Nikkaji
- J411.666F
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 19 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 189
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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