2,5-Dialkylpyrrolidines; 2-(5-Hexenyl)-5-nonylpyrrolidine

AlkaPlorer ID: AK295015

Synonym: None

IUPAC Name: 2-hex-5-enyl-5-nonylpyrrolidine

Structure

SMILES: C=CCCCCC1CCC(CCCCCCCCC)N1

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InChI: InChI=1S/C19H37N/c1-3-5-7-9-10-11-13-15-19-17-16-18(20-19)14-12-8-6-4-2/h4,18-20H,2-3,5-17H2,1H3

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InChIKey: VJYHAIYEEJOCLT-UHFFFAOYSA-N

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Reference

PubChem CID: 180891

CAS: 100594-88-5

COCONUT: CNP0251172.1

Source

Species Genus Family Order Class Phylum Kingdom Domain
Monomorium sp. Monomorium Formicidae Hymenoptera Insecta Arthropoda Metazoa Eukaryota

Properties Information

Molecule Weight: 279.5119999999999

TPSA: 12.03

MolLogP: 5.994100000000006

Number of H-Donors: 1

Number of H-Acceptors: 1

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Electrophorus electricus Acetylcholinesterase Ki 1500.0 nM 10.1016/0960-894X(95)00179-W
None No relevant target LogP 7.68 None 10.1016/0960-894X(95)00179-W
None Unchecked Venom 58.7 % 10.1016/0960-894X(95)00179-W

Metabolism Information