4-[1-(2-propenyl)-1,2,5,6-tetrahydropyridin-3-yl]-1H-indole
Basic information
- Standard SMILES
C=CCN1CCC=C(c2cccc3[nH]ccc23)C1- InChIKey
HMNMNVKKGHIFLH-UHFFFAOYSA-N- Molecular formula
- C16H18N2
- Average molar mass
- 238.33 g/mol
- Monoisotopic mass
- 238.14699858
Names & identifiers
- Preferred name
- 4-[1-(2-propenyl)-1,2,5,6-tetrahydropyridin-3-yl]-1H-indole
- IUPAC
- 4-(1-prop-2-enyl-3,6-dihydro-2H-pyridin-5-yl)-1H-indole
Names & synonyms
SCHEMBL11229113HMNMNVKKGHIFLH-UHFFFAOYSA-N4-[1-(2-propenyl)-1,2,5,6-tetrahydropyridin-3-yl]-1H-indole
Database identifiers
- PubChem CID
- 3068359
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 19 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 334
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Related reactions
2 records
Compound notes
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