Mrv1572004251606322D          

 32 33  0  0  0  0            999 V2000
    8.1101   -2.2688    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4043   -3.2878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9927   -4.4694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0222   -4.7241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7272   -1.0070    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0214    0.0120    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3903    1.1935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6393    1.4483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4887   -1.9239    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8942   -1.3519    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2813   -1.6951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1016   -1.5807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8758   -2.2672    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5071   -1.0087    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0555   -2.3816    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0648   -3.4112    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6726   -0.8943    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3182    0.1354    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8666   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5163   -2.0383    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2629   -2.6104    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1200   -0.6655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6500   -2.9536    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6592   -3.9833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2671   -0.3222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2763    0.7074    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4519   -3.7545    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0690    0.4786    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.6684   -2.0383    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -1.2375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.6592   -1.0087    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2763   -2.2672    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 10  9  1  0  0  0  0
 11  9  1  0  0  0  0
 12 10  1  0  0  0  0
 13 11  1  0  0  0  0
 14 12  1  0  0  0  0
 21 15  1  0  0  0  0
 21 16  1  0  0  0  0
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 22 18  1  0  0  0  0
 23  1  1  0  0  0  0
 23  2  1  0  0  0  0
 23 15  1  0  0  0  0
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 24  4  1  0  0  0  0
 24 16  1  0  0  0  0
 25  5  1  0  0  0  0
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 25 17  1  0  0  0  0
 26  7  1  0  0  0  0
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 27 24  1  0  0  0  0
 28 25  1  0  0  0  0
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 29 13  1  0  0  0  0
 29 19  1  0  0  0  0
 29 21  1  0  0  0  0
 30 14  1  0  0  0  0
 30 20  1  0  0  0  0
 30 22  1  0  0  0  0
 31 19  2  0  0  0  0
 32 20  2  0  0  0  0
M  END
> <DATABASE_ID>
CHEM009713

> <DATABASE_NAME>
chemdb

> <SMILES>
CC1(C)CC(CC(C)(C)N1)N(CCCCCCN(C=O)C1CC(C)(C)NC(C)(C)C1)C=O

> <INCHI_IDENTIFIER>
InChI=1S/C26H50N4O2/c1-23(2)15-21(16-24(3,4)27-23)29(19-31)13-11-9-10-12-14-30(20-32)22-17-25(5,6)28-26(7,8)18-22/h19-22,27-28H,9-18H2,1-8H3

> <INCHI_KEY>
UONLDZHKYCFZRW-UHFFFAOYSA-N

> <FORMULA>
C26H50N4O2

> <MOLECULAR_WEIGHT>
450.712

> <EXACT_MASS>
450.393376866

> <JCHEM_ACCEPTOR_COUNT>
4

> <JCHEM_ATOM_COUNT>
82

> <JCHEM_AVERAGE_POLARIZABILITY>
55.08985816148598

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
2

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
N-(2,2,6,6-tetramethylpiperidin-4-yl)-N-{6-[N-(2,2,6,6-tetramethylpiperidin-4-yl)formamido]hexyl}formamide

> <ALOGPS_LOGP>
3.22

> <JCHEM_LOGP>
2.1077881386666646

> <ALOGPS_LOGS>
-4.51

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
2

> <JCHEM_PHYSIOLOGICAL_CHARGE>
2

> <JCHEM_PKA_STRONGEST_BASIC>
10.687928804336579

> <JCHEM_POLAR_SURFACE_AREA>
64.68

> <JCHEM_REFRACTIVITY>
132.82139999999998

> <JCHEM_ROTATABLE_BOND_COUNT>
9

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
1.41e-02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
N-(2,2,6,6-tetramethylpiperidin-4-yl)-N-{6-[N-(2,2,6,6-tetramethylpiperidin-4-yl)formamido]hexyl}formamide

> <JCHEM_VEBER_RULE>
0

> <NAME>
Formamide, N,N'-1,6-hexanediylbis[N-(2,2,6,6-tetramethyl-4-piperidinyl)-

> <CAS>
124172-53-8

> <SYNONYMS>
N,N'-1,6-hexanediylbis(N-(2,2,6,6-tetramethyl-piperidin-4-yl)formamide

$$$$