6,7-Diethoxy-4-(indan-5-ylamino)-quinoline-3-carbonitrile

HCID 9969578
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Basic information

Standard SMILES
CCOc1cc2ncc(C#N)c(Nc3ccc4c(c3)CCC4)c2cc1OCC
InChIKey
IRYNXXKQLIQSNU-UHFFFAOYSA-N
Molecular formula
C23H23N3O2
Average molar mass
373.4 g/mol
Monoisotopic mass
373.17902698

Names & identifiers

Preferred name
6,7-Diethoxy-4-(indan-5-ylamino)-quinoline-3-carbonitrile
IUPAC
4-(2,3-dihydro-1H-inden-5-ylamino)-6,7-diethoxyquinoline-3-carbonitrile

Names & synonyms

SCHEMBL2204857IRYNXXKQLIQSNU-UHFFFAOYSA-N6,7-Diethoxy-4-(indan-5-ylamino)-quinoline-3-carbonitrile

Database identifiers

PubChem CID
9969578

Properties

Computed structural properties

XLogP
5.5
Topological polar surface area
67.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
28

Related reactions

2 records
New reaction record

Linked notes

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