Basic information
- CAS
61640-23-1- Standard SMILES
CCN(CC)CC#Cc1ccc2c(ccn2C)c1- InChIKey
YFKHIGRYEXUCIQ-UHFFFAOYSA-N- Molecular formula
- C16H20N2
- Average molar mass
- 240.34 g/mol
- Monoisotopic mass
- 240.16264865
Names & identifiers
- Preferred name
- 2-Propyn-1-amine, N,N-diethyl-3-(1-methyl-1H-indol-5-yl)-
- IUPAC
- N,N-diethyl-3-(1-methylindol-5-yl)prop-2-yn-1-amine
Names & synonyms
2-Propyn-1-amine, N,N-diethyl-3-(1-methyl-1H-indol-5-yl)-61640-23-1DTXSID20485618N,N-Diethyl-3-(1-methyl-1H-indol-5-yl)prop-2-yn-1-amine
Database identifiers
- CAS
61640-23-1- PubChem CID
- 12296263
- DTXSID
DTXSID20485618
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 8.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 320
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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