Completing data — usually done within a minute
Basic information
- CAS
17380-42-6- Standard SMILES
CN(C)CCc1c[nH]c2ccc(C#N)cc12- InChIKey
DSNBRTOYUJFTAH-UHFFFAOYSA-N- Molecular formula
- C13H15N3
- Average molar mass
- 213.28 g/mol
- Monoisotopic mass
- 213.12659749
Names & identifiers
- Preferred name
- Indole-5-carbonitrile, 3-(2-dimethylaminoethyl)-
- IUPAC
- 3-[2-(dimethylamino)ethyl]-1H-indole-5-carbonitrile
Names & synonyms
5-Cyano-N,N-dimethyltryptamine17380-42-6INDOLE-5-CARBONITRILE, 3-(2-DIMETHYLAMINOETHYL)-3-(2-Dimethylamino)ethylindole-5-carbonitrileDTXSID60169667RefChem:349336DTXCID60921583-[2-(dimethylamino)ethyl]-1H-indole-5-carbonitrile3-(2-(Dimethylamino)ethyl)-1H-indole-5-carbonitrileSCHEMBL1122134DSNBRTOYUJFTAH-UHFFFAOYSA-NDA-09298
Show more names
3-(2-dimethylamino-ethyl)-1H-indole-5-carbonitrileN,N-dimethyl 2-(5-cyano-1H-indol-3-yl)ethyl-amine
Database identifiers
- CAS
17380-42-6- PubChem CID
- 28511
- DTXSID
DTXSID60169667
Properties
Computed structural propertiesFilling in
- XLogP
- 1.3
- Topological polar surface area
- 42.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 278
Related reactions
19 records
Compound notes
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