Molecule

1-Methylpiperidine

AlkaPlorer ID: AK257238

Synonym: Methylpiperidylamine

IUPAC Name: 1-methylpiperidine

SMILES: CN1CCCCC1

InChI: InChI=1S/C6H13N/c1-7-5-3-2-4-6-7/h2-6H2,1H3

InChIKey: PAMIQIKDUOTOBW-UHFFFAOYSA-N

PubChem CID: 176252478

CAS: 139252-84-9

SuperNatural Ⅲ: SN0280102

COCONUT: CNP0325316

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Girgensohnia oppositiflora	Girgensohnia	Chenopodiaceae	Caryophyllales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Girgensohnia diptera	Girgensohnia	Chenopodiaceae	Caryophyllales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Molecule Weight: 99.177

TPSA？: 3.24

MolLogP？: 1.1021

Number of H-Donors: 0

Number of H-Acceptors: 1

RingCount: 1

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi
Rattus norvegicus	Neuronal acetylcholine receptor	Enhancement	24.0	%	10.1021/jm00147a021
Rattus norvegicus	Neuronal acetylcholine receptor	Inhibition	173.0	%	10.1021/jm00147a021
Rattus norvegicus	Neuronal acetylcholine receptor	Kd	1200000.0	nM	10.1021/jm00147a021
Rattus norvegicus	Neuronal acetylcholine receptor	Kd	nan	nM	10.1021/jm00147a021
Rattus norvegicus	Neuronal acetylcholine receptor	Mean enhancement of binding	10.0	None	10.1021/jm00147a021
None	No relevant target	delta pKa	0.0	None	10.1021/jm981133m
None	No relevant target	pKa	8.1	None	10.1016/j.bmcl.2011.11.061
None	No relevant target	pKa	10.1	None	10.1007/s11095-013-1232-z
None	Unchecked	RPE	0.0	None	10.1021/jm981133m