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N-cyclohexyl-7-methyl-4-propan-2-yl-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide

HCID 21982952
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CC(C)n1cc2c3c(cccc31)C1CC(C(=O)NC3CCCCC3)CN(C)C1C2
InChIKey
KEMOOQHMCGCZKH-UHFFFAOYSA-N
Molecular formula
C25H35N3O
Average molar mass
393.6 g/mol
Monoisotopic mass
393.27801275

Names & identifiers

Preferred name
N-cyclohexyl-7-methyl-4-propan-2-yl-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide
IUPAC
N-cyclohexyl-7-methyl-4-propan-2-yl-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide

Names & synonyms

LY 237733BDBM82516NSC_60740CAS_121588-75-8L000711N-cyclohexyl-7-methyl-4-propan-2-yl-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide

Database identifiers

PubChem CID
21982952

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
37.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
29
Formal charge
0
Complexity
601

Related reactions

1 records
New reaction record
HRID 296843 reaction equation
HRID 296843As productTraining data from https://doi.org/10.1039/C8SC04228D (8/10)

Compound notes

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