2-(6-methoxy-2-naphthyl)-3-pentyl-1H-indole

HCID 22327342

Notes Reactions

Substructure search Find similar structures

Basic information

Standard SMILES: CCCCCc1c(-c2ccc3cc(OC)ccc3c2)[nH]c2ccccc12
InChIKey: GUQMHMDRZYULMR-UHFFFAOYSA-N
Molecular formula: C24H25NO
Average molar mass: 343.5 g/mol

Names & identifiers

Preferred name: 2-(6-methoxy-2-naphthyl)-3-pentyl-1H-indole
IUPAC: 2-(6-methoxynaphthalen-2-yl)-3-pentyl-1H-indole

Names & synonyms

SCHEMBL4024478GUQMHMDRZYULMR-UHFFFAOYSA-N2-(6-methoxy-2-naphthyl)-3-pentyl-1H-indole

Database identifiers

PubChem CID: 22327342

Properties

Computed structural properties

XLogP: 7.4
Topological polar surface area: 25 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 6
Heavy atoms: 26
Formal charge: 0
Complexity: 438

Related reactions

9 records

New reaction record

HRID 392290As productuspto-grants-2004_10

HRID 392293As reactantuspto-grants-2004_10

HRID 495495As productuspto-grants-2005_09

HRID 495498As reactantuspto-grants-2005_09

HRID 898288As productuspto-grants-2008_04

HRID 898291As reactantuspto-grants-2008_04

HRID 1540989As reactantTraining data from https://doi.org/10.1039/C8SC04228D (1/10)

HRID 1866469As productuspto-grants-2009_12

Compound notes

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