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6-(1H-indol-3-yl)hexan-1-amine

HCID 3275741
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
NCCCCCCc1c[nH]c2ccccc12
InChIKey
GSOQFCIVGOXYMC-UHFFFAOYSA-N
Molecular formula
C14H20N2
Average molar mass
216.32 g/mol
Monoisotopic mass
216.16264865

Names & identifiers

Preferred name
6-(1H-indol-3-yl)hexan-1-amine
IUPAC
6-(1H-indol-3-yl)hexan-1-amine

Names & synonyms

6-(1H-indol-3-yl)hexan-1-amine41055-61-26-(1H-indol-3-yl)hexylamineSCHEMBL2378528GSOQFCIVGOXYMC-UHFFFAOYSA-NCCG-22675EN300-1856844

Database identifiers

PubChem CID
3275741

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
41.8 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
1
Rotatable bonds
6
Heavy atoms
16
Formal charge
0
Complexity
193

Related reactions

2 records
New reaction record
HRID 908977 reaction equation
HRID 908977As reactantuspto-grants-2011_09
HRID 2343990 reaction equation
HRID 2343990As reactantTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

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