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4-Methyl-2,3,4,5-tetrahydropyridin-6-amine , CAS No.165383-71-1

In stock
Item Number
M668825
Grouped product items
SKU Size
Availability
Price Qty
M668825-1mg
1mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$999.90
M668825-5mg
5mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$2,999.90

Basic Description

Synonyms 2-imino-4-methylpiperidine | 4-methyl-2,3,4,5-tetrahydropyridin-6-amine | 4-Methyl-piperidin-(2E)-ylideneamine | DTXSID00390857 | CHEBI:183992 | BDBM50062133 | 4-Methyl-piperidin-(2Z)-ylideneamine | AKOS006348873 | PD050547 | FT-0722141 | 524943-80-4

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
Superclass Organoheterocyclic compounds
Class Pyridines and derivatives
Subclass Hydropyridines
Intermediate Tree Nodes Not available
Direct Parent Tetrahydropyridines
Alternative Parents Imidolactams  Propargyl-type 1,3-dipolar organic compounds  Carboximidamides  Carboxamidines  Azacyclic compounds  Hydrocarbon derivatives  Amines  
Molecular Framework Aliphatic heteromonocyclic compounds
Substituents Tetrahydropyridine - Imidolactam - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Carboxylic acid amidine - Amidine - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Amine - Aliphatic heteromonocyclic compound
Description This compound belongs to the class of organic compounds known as tetrahydropyridines. These are derivatives of pyridine in which two double bonds in the pyridine moiety are reduced by adding four hydrogen atoms.
External Descriptors Not available

Product Properties

ALogP -0.1

Associated Targets(Human)

NOS2 Tchem Nitric oxide synthase, inducible (3 Activities)
Activity Type Activity Value -log(M) Mechanism of Action Activity Reference Publications (PubMed IDs)
NOS1 Tchem Nitric oxide synthase, brain (2 Activities)
Activity Type Activity Value -log(M) Mechanism of Action Activity Reference Publications (PubMed IDs)
NOS3 Tchem Nitric oxide synthase, endothelial (2 Activities)
Activity Type Activity Value -log(M) Mechanism of Action Activity Reference Publications (PubMed IDs)
NOS1 Tchem Nitric-oxide synthase, brain (1786 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
NOS3 Tchem Nitric-oxide synthase, endothelial (1452 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
NOS1 Tchem Nitric oxide sythases; iNOS & nNOS (685 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID

Associated Targets(non-human)

Nos2 Nitric oxide synthase, inducible (3573 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Mus musculus (284745 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Rattus norvegicus (775804 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID

Mechanisms of Action

Mechanism of Action Action Type target ID Target Name Target Type Target Organism Binding Site Name References

Names and Identifiers

IUPAC Name 4-methyl-2,3,4,5-tetrahydropyridin-6-amine
INCHI InChI=1S/C6H12N2/c1-5-2-3-8-6(7)4-5/h5H,2-4H2,1H3,(H2,7,8)
InChIKey GGDLOMFAKKVDPT-UHFFFAOYSA-N
Smiles CC1CCN=C(C1)N
Isomeric SMILES CC1CCN=C(C1)N
Molecular Weight 112.17
Reaxy-Rn 46811714
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=46811714&ln=

Certificates(CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Chemical and Physical Properties

Molecular Weight 112.170 g/mol
XLogP3 -0.100
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 0
Exact Mass 112.1 Da
Monoisotopic Mass 112.1 Da
Topological Polar Surface Area 38.400 Ų
Heavy Atom Count 8
Formal Charge 0
Complexity 107.000
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
The total count of all stereochemical bonds 0
Covalently-Bonded Unit Count 1

Solution Calculators

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