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Methylanabasine

CAT: 0926-ZAA38092-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0926-ZAA38092-02Size:50 mg
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CAS Number
24380-92-5
MDL Number
MFCD00871392
Smiles
CN1CCCCC1C2=CN=CC=C2
Molecular Formula
C11H16N2
Molecular Weight
176.26 g/mol
Controlled
No

Chemical Information

3-((2S)-1-Methyl-2-piperidinyl)pyridine
CAS Number24380-92-5
PubChem CID927709
IUPAC Name3-[(2S)-1-methylpiperidin-2-yl]pyridine
Molecular FormulaC11H16N2
Molecular Weight176.26
XLogP1
Topological Polar Surface Area16.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count13
Formal Charge0
Complexity158
SMILES
CN1CCCC[C@H]1C2=CN=CC=C2
InChI
InChI=1S/C11H16N2/c1-13-8-3-2-6-11(13)10-5-4-7-12-9-10/h4-5,7,9,11H,2-3,6,8H2,1H3/t11-/m0/s1
InChIKey
WHAIHNKQZOMXJJ-NSHDSACASA-N
Chemical Structure
2D Structure
2D structure of 3-((2S)-1-Methyl-2-piperidinyl)pyridine
CAS: 24380-92-5
CID: 927709
Formula: C11H16N2
MW: 176.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight176.26
XLogP31
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass176.131348519
Monoisotopic Mass176.131348519
Topological Polar Surface Area16.1 Ų
Heavy Atom Count13
Formal Charge0
Complexity158
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
sc-212241N-Methylanabasine

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