Tert-butyl 5-pyridin-4-yl-indole-1-carboxylate

HCID 68857022
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Basic information

Standard SMILES
CC(C)(C)OC(=O)n1ccc2cc(-c3ccncc3)ccc21
InChIKey
LBJWAIITMDTTNT-UHFFFAOYSA-N
Molecular formula
C18H18N2O2
Average molar mass
294.3 g/mol

Names & identifiers

Preferred name
Tert-butyl 5-pyridin-4-yl-indole-1-carboxylate
IUPAC
tert-butyl 5-pyridin-4-ylindole-1-carboxylate

Names & synonyms

tert-butyl 5-pyridin-4-yl-indole-1-carboxylate926028-78-6SCHEMBL3964381LBJWAIITMDTTNT-UHFFFAOYSA-N1h-indole-1-carboxylic acid,5-(4-pyridinyl)-,1,1-dimethylethyl esterDB-353075

Database identifiers

PubChem CID
68857022

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
44.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
22

Related reactions

2 records
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Compound notes

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