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2-(4-Dimethylamino-4-phenylcyclohexylidene)-N-[6-(1H-indol-3-yl)hexyl]acetamide

HCID 11547749
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CN(C)C1(c2ccccc2)CCC(=CC(=O)NCCCCCCc2c[nH]c3ccccc23)CC1
InChIKey
BQSIZGBAPZAEMM-UHFFFAOYSA-N
Molecular formula
C30H39N3O
Average molar mass
457.6 g/mol
Monoisotopic mass
457.30931288

Names & identifiers

Preferred name
2-(4-Dimethylamino-4-phenylcyclohexylidene)-N-[6-(1H-indol-3-yl)hexyl]acetamide
IUPAC
2-[4-(dimethylamino)-4-phenylcyclohexylidene]-N-[6-(1H-indol-3-yl)hexyl]acetamide

Names & synonyms

SCHEMBL2378561BQSIZGBAPZAEMM-UHFFFAOYSA-N2-(4-Dimethylamino-4-phenylcyclohexylidene)-N-[6-(1H-indol-3-yl)hexyl]acetamide

Database identifiers

PubChem CID
11547749

Properties

Computed structural properties

XLogP
5.9
Topological polar surface area
48.1 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
10
Heavy atoms
34
Formal charge
0
Complexity
656

Related reactions

3 records
New reaction record
HRID 190957 reaction equation
HRID 190957As productAs reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 908944 reaction equation
HRID 908944As productuspto-grants-2011_09
HRID 908945 reaction equation
HRID 908945As reactantuspto-grants-2011_09

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes