(1SR,8RS)-5-(2,2-Dimethyl-propyl)-3,4-diaza-tricyclo[6.2.1.02,7]undeca-2,4,6,-triene

HCID 69059352
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Basic information

Standard SMILES
CC(C)(C)Cc1cc2c(nn1)C1CCC2C1
InChIKey
CMKPMUDBSAPGIA-UHFFFAOYSA-N
Molecular formula
C14H20N2
Average molar mass
216.32 g/mol

Names & identifiers

Preferred name
(1SR,8RS)-5-(2,2-Dimethyl-propyl)-3,4-diaza-tricyclo[6.2.1.02,7]undeca-2,4,6,-triene
IUPAC
5-(2,2-dimethylpropyl)-3,4-diazatricyclo[6.2.1.02,7]undeca-2(7),3,5-triene

Names & synonyms

SCHEMBL4480399CMKPMUDBSAPGIA-UHFFFAOYSA-N(1SR,8RS)-5-(2,2-Dimethyl-propyl)-3,4-diaza-tricyclo[6.2.1.02,7]undeca-2,4,6,-triene

Database identifiers

PubChem CID
69059352

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
25.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
16

Related reactions

1 records
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Compound notes

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