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Home > Imidazoles > 130516-99-3
130516-99-3 | Piperidine, 4-[2-(2-methyl-1H-imidazol-1-yl)ethyl]-
CAS No: 130516-99-3 Catalog No: AG000UJS MDL No:MFCD07643298
Product Description
Catalog Number:
AG000UJS
Chemical Name:
Piperidine, 4-[2-(2-methyl-1H-imidazol-1-yl)ethyl]-
CAS Number:
130516-99-3
Molecular Formula:
C11H19N3
Molecular Weight:
193.2887
MDL Number:
MFCD07643298
IUPAC Name:
4-[2-(2-methylimidazol-1-yl)ethyl]piperidine
InChI:
InChI=1S/C11H19N3/c1-10-13-7-9-14(10)8-4-11-2-5-12-6-3-11/h7,9,11-12H,2-6,8H2,1H3
InChI Key:
FPCPADMQGUJDCY-UHFFFAOYSA-N
SMILES:
Cc1nccn1CCC1CCNCC1
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.158g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
193.294g/mol
Monoisotopic Mass:
193.158g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
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