5-(Oct-1-ynyl)-1H-indole

HCID 66726751
Substructure searchFind similar structures

Basic information

Standard SMILES
CCCCCCC#Cc1ccc2[nH]ccc2c1
InChIKey
XYELVPZRAAWPRY-UHFFFAOYSA-N
Molecular formula
C16H19N
Average molar mass
225.33 g/mol
Monoisotopic mass
225.15174961

Names & identifiers

Preferred name
5-(Oct-1-ynyl)-1H-indole
IUPAC
5-oct-1-ynyl-1H-indole

Names & synonyms

SCHEMBL5663495-(Oct-1-ynyl)-1H-indoleXYELVPZRAAWPRY-UHFFFAOYSA-N

Database identifiers

PubChem CID
66726751

Properties

Computed structural properties

XLogP
5.7
Topological polar surface area
15.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
0
Rotatable bonds
5
Heavy atoms
17

Related reactions

5 records
New reaction record

Linked notes

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