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4-(3-Piperidinylmethyl)pyridine

CAT: 0572-TRC-P991638-250MGSize: 250 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-P991638-250MGSize:250 mg
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CAS Number
1337356-78-1
Hazard Statement
No Data Available
Smiles
N=1C=CC(=CC1)CC2CNCCC2
Molecular Formula
C11H16N2
Molecular Weight
176.26
InChI
InChI=1S/C11H16N2/c1-2-11(9-13-5-1)8-10-3-6-12-7-4-10/h3-4,6-7,11,13H,1-2,5,8-9H2
Additionnal Information
IUPAC name: 4-(piperidin-3-ylmethyl)pyridine
Shipping Conditions
Room Temperature

Chemical Information

4-(3-Piperidylmethyl)pyridine
CAS Number1337356-78-1
PubChem CID83481926
IUPAC Name4-(piperidin-3-ylmethyl)pyridine
Molecular FormulaC11H16N2
Molecular Weight176.26
XLogP1.4
Topological Polar Surface Area24.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count13
Formal Charge0
Complexity141
SMILES
C1CC(CNC1)CC2=CC=NC=C2
InChI
InChI=1S/C11H16N2/c1-2-11(9-13-5-1)8-10-3-6-12-7-4-10/h3-4,6-7,11,13H,1-2,5,8-9H2
InChIKey
OPAWRULAUSLMKC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-(3-Piperidylmethyl)pyridine
CAS: 1337356-78-1
CID: 83481926
Formula: C11H16N2
MW: 176.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight176.26
XLogP31.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass176.131348519
Monoisotopic Mass176.131348519
Topological Polar Surface Area24.9 Ų
Heavy Atom Count13
Formal Charge0
Complexity141
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
428908-014- (3-Piperidinylmethyl) pyridine
OR10837033-Bromo-4- (1-piperidinylmethyl) pyridine
sc-4764402- (4-Piperidinylmethyl) pyridine Dihydrochloride
422952-013- (4-Piperidinylmethyl) pyridine Hydrochloride (1:2)
sc-2654562-Bromo-4- (1-piperidinylmethyl) pyridine
420288-012,4-Dimethyl-6- (2-piperidinylmethyl) pyridine
436372-015-Ethyl-2- (2-piperidinylmethyl) pyridine
OR9052302-Methyl-6- (2-piperidinylmethyl) pyridine
sc-4764425- (4-Piperidinylmethyl) pyrimidine
OR3700933-Chloro-N- (4-piperidinylmethyl) benzamide hydrochloride

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