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115883-22-2 | 2,6-Piperidinedione, 3-(4-aminophenyl)-3-cyclohexyl-
CAS No: 115883-22-2 Catalog No: AG0013JT MDL No:
Product Description
Catalog Number:
AG0013JT
Chemical Name:
2,6-Piperidinedione, 3-(4-aminophenyl)-3-cyclohexyl-
CAS Number:
115883-22-2
Molecular Formula:
C17H22N2O2
Molecular Weight:
286.3688
IUPAC Name:
3-(4-aminophenyl)-3-cyclohexylpiperidine-2,6-dione
InChI:
InChI=1S/C17H22N2O2/c18-14-8-6-13(7-9-14)17(12-4-2-1-3-5-12)11-10-15(20)19-16(17)21/h6-9,12H,1-5,10-11,18H2,(H,19,20,21)
InChI Key:
NTKWRAAWKFNECW-UHFFFAOYSA-N
SMILES:
O=C1CCC(C(=O)N1)(C1CCCCC1)c1ccc(cc1)N
Properties
Complexity:
409
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.168g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
286.375g/mol
Monoisotopic Mass:
286.168g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
72.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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