1-Pentyl-9-azabicyclo[3.3.1]nonan-3-one

AlkaPlorer ID: AK309768

Synonym: Adaline

IUPAC Name: 1-pentyl-9-azabicyclo[3.3.1]nonan-3-one

Structure

SMILES: CCCCCC12CCCC(CC(=O)C1)N2

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InChI: InChI=1S/C13H23NO/c1-2-3-4-7-13-8-5-6-11(14-13)9-12(15)10-13/h11,14H,2-10H2,1H3

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InChIKey: KHMVXSQLPUNRCF-UHFFFAOYSA-N

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Reference

PubChem CID: 53462466

CAS: 41267-60-1

COCONUT: CNP0280269.2

Source

Species Genus Family Order Class Phylum Kingdom Domain
Adalia bipunctata Adalia Coccinellidae Coleoptera Insecta Arthropoda Metazoa Eukaryota

Properties Information

Molecule Weight: 209.333

TPSA: 29.1

MolLogP: 2.810500000000001

Number of H-Donors: 1

Number of H-Acceptors: 2

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information