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14759-09-2 | Piperidine, 1-[2-(4-piperidinyl)ethyl]-
CAS No: 14759-09-2 Catalog No: AG001F00 MDL No:MFCD00053588
Product Description
Catalog Number:
AG001F00
Chemical Name:
Piperidine, 1-[2-(4-piperidinyl)ethyl]-
CAS Number:
14759-09-2
Molecular Formula:
C12H24N2
Molecular Weight:
196.3324
MDL Number:
MFCD00053588
IUPAC Name:
1-(2-piperidin-4-ylethyl)piperidine
InChI:
InChI=1S/C12H24N2/c1-2-9-14(10-3-1)11-6-12-4-7-13-8-5-12/h12-13H,1-11H2
InChI Key:
FKYVHDSPGMMDFF-UHFFFAOYSA-N
SMILES:
C1CCN(CC1)CCC1CCNCC1
NSC Number:
166303
Properties
Complexity:
146
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.194g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
196.338g/mol
Monoisotopic Mass:
196.194g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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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