Mrv1572004221604312D          

 23 25  0  0  0  0            999 V2000
    3.4914    3.4105    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7934   -0.1914    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3645    5.5836    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1914    1.9816    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5079    0.2211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0789    0.2211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6500    5.1711    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0789    5.1711    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6039    1.2671    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6039    2.6961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5079    1.0461    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0789    1.0461    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6500    4.3461    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0789    4.3461    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    1.2671    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    2.6961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7934    1.4586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3645    3.9336    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8414    1.9816    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7934    2.2836    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.3645    3.1086    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.6664    1.9816    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.0789    2.6961    0.0000 Si  0  0  0  0  0  0  0  0  0  0  0  0
  5  2  1  0  0  0  0
  6  2  1  0  0  0  0
  7  3  1  0  0  0  0
  8  3  1  0  0  0  0
  9  4  1  0  0  0  0
 10  4  1  0  0  0  0
 11  5  1  0  0  0  0
 12  6  1  0  0  0  0
 13  7  1  0  0  0  0
 14  8  1  0  0  0  0
 15  9  1  0  0  0  0
 16 10  1  0  0  0  0
 17 11  1  0  0  0  0
 17 12  1  0  0  0  0
 18 13  1  0  0  0  0
 18 14  1  0  0  0  0
 19 15  1  0  0  0  0
 19 16  1  0  0  0  0
 20 17  1  0  0  0  0
 21 18  1  0  0  0  0
 22 19  1  0  0  0  0
 23  1  1  0  0  0  0
 23 20  1  0  0  0  0
 23 21  1  0  0  0  0
 23 22  1  0  0  0  0
M  END
> <DATABASE_ID>
CHEM010440

> <DATABASE_NAME>
chemdb

> <SMILES>
C[Si](NC1CCCCC1)(NC1CCCCC1)NC1CCCCC1

> <INCHI_IDENTIFIER>
InChI=1S/C19H39N3Si/c1-23(20-17-11-5-2-6-12-17,21-18-13-7-3-8-14-18)22-19-15-9-4-10-16-19/h17-22H,2-16H2,1H3

> <INCHI_KEY>
HDNXAGOHLKHJOA-UHFFFAOYSA-N

> <FORMULA>
C19H39N3Si

> <MOLECULAR_WEIGHT>
337.627

> <EXACT_MASS>
337.291324803

> <JCHEM_ACCEPTOR_COUNT>
3

> <JCHEM_ATOM_COUNT>
62

> <JCHEM_AVERAGE_POLARIZABILITY>
41.31168194420901

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
3

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
N,N',N''-tricyclohexyl-1-methylsilanetriamine

> <ALOGPS_LOGP>
3.42

> <JCHEM_LOGP>
4.5351

> <ALOGPS_LOGS>
-4.72

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
3

> <JCHEM_PKA_STRONGEST_BASIC>
12.190996215875073

> <JCHEM_POLAR_SURFACE_AREA>
36.089999999999996

> <JCHEM_REFRACTIVITY>
127.20269999999998

> <JCHEM_ROTATABLE_BOND_COUNT>
6

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
6.37e-03 g/l

> <JCHEM_TRADITIONAL_IUPAC>
N,N',N''-tricyclohexyl-1-methylsilanetriamine

> <JCHEM_VEBER_RULE>
1

> <NAME>
Silanetriamine, N,N',N''-tricyclohexyl-1-methyl-

> <CAS>
15901-40-3

> <SYNONYMS>
N,N',N''-Tricyclohexyl-1-methylsilanetriamine; N,N',N''-tricyclohexyl-1-methylsilanetriamine

$$$$