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Home > Pyridines > 1018163-64-8
1018163-64-8 | 2-CYCLOPENTYL-3,4-DIMETHYL-2,7-DIHYDRO-6H-PYRAZOLO[3,4-B]PYRIDIN-6-ONE
CAS No: 1018163-64-8 Catalog No: AG01AOEE MDL No:MFCD09834182
Product Description
Catalog Number:
AG01AOEE
Chemical Name:
2-CYCLOPENTYL-3,4-DIMETHYL-2,7-DIHYDRO-6H-PYRAZOLO[3,4-B]PYRIDIN-6-ONE
CAS Number:
1018163-64-8
Molecular Formula:
C13H17N3O
Molecular Weight:
231.2936
MDL Number:
MFCD09834182
IUPAC Name:
2-cyclopentyl-3,4-dimethyl-7H-pyrazolo[3,4-b]pyridin-6-one
InChI:
InChI=1S/C13H17N3O/c1-8-7-11(17)14-13-12(8)9(2)16(15-13)10-5-3-4-6-10/h7,10H,3-6H2,1-2H3,(H,14,15,17)
InChI Key:
HYMHINRGJKITJF-UHFFFAOYSA-N
SMILES:
O=c1cc(C)c2c([nH]1)nn(c2C)C1CCCC1
Properties
Complexity:
360
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.137g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
231.299g/mol
Monoisotopic Mass:
231.137g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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