Home Other Building Blocks 2-Methylpiperidine

2-Methylpiperidine

CAS No.:
109-05-7
Catalog Number:
AG0033ED
Molecular Formula:
C6H13N
Molecular Weight:
99.1741
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Product Description
Catalog Number:
AG0033ED
Chemical Name:
2-Methylpiperidine
CAS Number:
109-05-7
Molecular Formula:
C6H13N
Molecular Weight:
99.1741
MDL Number:
MFCD00005982
IUPAC Name:
2-methylpiperidine
InChI:
InChI=1S/C6H13N/c1-6-4-2-3-5-7-6/h6-7H,2-5H2,1H3
InChI Key:
NNWUEBIEOFQMSS-UHFFFAOYSA-N
SMILES:
CC1CCCCN1
EC Number:
203-642-1
FEMA Number:
4244
Properties
Complexity:
52.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
99.105g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
99.177g/mol
Monoisotopic Mass:
99.105g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Literature
Title Journal
Noncyclam tetraamines inhibit CXC chemokine receptor type 4 and target glioma-initiating cells. Journal of medicinal chemistry 20120913
Bis(2-methyl-piperidinium) naphthalene-1,5-disulfonate. Acta crystallographica. Section E, Structure reports online 20120601
2-Methyl-piperidinium bromide. Acta crystallographica. Section E, Structure reports online 20120601
Tris(2-methyl-piperidinium) tetra-chlorido-ferrate dichloride. Acta crystallographica. Section E, Structure reports online 20120501
Intramolecular aminoalkene hydroamination mediated by a tethered bis(ureate)zirconium complex: computational perusal of various pathways for aminoalkene activation. Inorganic chemistry 20120319
Mechanistic elucidation of intramolecular aminoalkene hydroamination catalyzed by a tethered bis(ureate) complex: evidence for proton-assisted C-N bond formation at zirconium. Journal of the American Chemical Society 20111005
Synthesis, trypanocidal activity and molecular modeling studies of 2-alkylaminomethylquinoline derivatives. European journal of medicinal chemistry 20110901
Aminopyrazine inhibitors binding to an unusual inactive conformation of the mitotic kinase Nek2: SAR and structural characterization. Journal of medicinal chemistry 20101111
Analysis of vibrational spectra of 2 and 3-methylpiperidine based on density functional theory calculations. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20090915
[Regioselectivity in the dehydrogenation of substituted ethylenediamines as nicotine models]. Die Pharmazie 20090901
Efficient solid-phase synthesis of sulfotyrosine peptides using a sulfate protecting-group strategy. Angewandte Chemie (International ed. in English) 20090101
Direct chemical synthesis of chiral methanol of 98% ee and its conversion to [(2)H1,(3)H]methyl tosylate and [(2)H1,(3)H-methyl]methionine. Journal of the American Chemical Society 20051012
Mechanism of hydrodenitrogenation on phosphides and sulfides. The journal of physical chemistry. B 20050217
Synthesis and repellent efficacy of a new chiral piperidine analog: comparison with Deet and Bayrepel activity in human-volunteer laboratory assays against Aedes aegypti and Anopheles stephensi. Journal of medical entomology 20030501
Release of nitric oxide from novel diazeniumdiolates monitored by laser magnetic resonance spectroscopy. Nitric oxide : biology and chemistry 20020301
Stereochemical effects in an insect repellent. Journal of medical entomology 20011101
Properties