5-Cyanotryptamine
Basic information
- CAS
46276-24-8- Standard SMILES
N#Cc1ccc2[nH]cc(CCN)c2c1- InChIKey
NYEZIGVQPDFDQF-UHFFFAOYSA-N- Molecular formula
- C11H11N3
- Average molar mass
- 185.22 g/mol
- Monoisotopic mass
- 185.09529736
Names & identifiers
- Preferred name
- 5-Cyanotryptamine
- IUPAC
- 3-(2-aminoethyl)-1H-indole-5-carbonitrile
Names & synonyms
5-Cyanotryptamine46276-24-8DTXSID00275635RefChem:302717DTXCID501985673-(2-aminoethyl)-1H-indole-5-carbonitrileSCHEMBL25316005-cyano-1H-indole-3-ethanamine3-(2-aminoethyl)-5-cyanoindoleNYEZIGVQPDFDQF-UHFFFAOYSA-NAKOS006280267DS-016516
Show more names
CS-0270633EN300-245119
Database identifiers
- CAS
46276-24-8- PubChem CID
- 58926
- DTXSID
DTXSID00275635
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 65.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 242
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Related reactions
9 records
Compound notes
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