7-bromo-3,4,5,6-tetrahydro-1H-2,5-ethanoazepino[4,3-b]indole

HCID 67240163
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Basic information

Standard SMILES
Brc1cccc2c3c([nH]c12)C1CCN(CC1)C3
InChIKey
YNMHSEDTFOLSGM-UHFFFAOYSA-N
Molecular formula
C14H15BrN2
Average molar mass
291.19 g/mol

Names & identifiers

Preferred name
7-bromo-3,4,5,6-tetrahydro-1H-2,5-ethanoazepino[4,3-b]indole
IUPAC
5-bromo-3,12-diazatetracyclo[10.2.2.02,10.04,9]hexadeca-2(10),4(9),5,7-tetraene

Names & synonyms

SCHEMBL1992479YNMHSEDTFOLSGM-UHFFFAOYSA-N7-bromo-3,4,5,6-tetrahydro-1H-2,5-ethanoazepino[4,3-b]indole

Database identifiers

PubChem CID
67240163

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
19 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
0
Heavy atoms
17

Related reactions

37 records
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Linked notes

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