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Home > Pyridines > 1258639-95-0
1258639-95-0 | 2-{5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyridin-3-yl}piperidine
CAS No: 1258639-95-0 Catalog No: AG01A8YI MDL No:MFCD17167113
Product Description
Catalog Number:
AG01A8YI
Chemical Name:
2-{5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyridin-3-yl}piperidine
CAS Number:
1258639-95-0
Molecular Formula:
C11H18N4
Molecular Weight:
206.2874
MDL Number:
MFCD17167113
IUPAC Name:
3-piperidin-2-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine
InChI:
InChI=1S/C11H18N4/c1-3-7-12-9(5-1)11-14-13-10-6-2-4-8-15(10)11/h9,12H,1-8H2
InChI Key:
IQNJOWIQIFYJMK-UHFFFAOYSA-N
SMILES:
C1CCC(NC1)c1nnc2n1CCCC2
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.153g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
206.293g/mol
Monoisotopic Mass:
206.153g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
42.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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