4032
  -OEChem-05102419252D

 33 34  0     1  0  0  0  0  0999 V2000
    2.5314   -1.0128    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.0640    0.4117    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4061   -0.5280    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    5.0376    1.0300    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.7788    0.0641    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.3010    2.0126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4365    0.5212    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1777   -0.4448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5792    1.2864    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0824    0.2209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5969   -1.5096    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5140   -2.0126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0236    0.4102    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7968   -0.5557    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6188    2.5450    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6878    2.1046    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0305    0.3434    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6315    1.1097    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9828   -1.0333    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7717   -0.6225    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1215    1.5869    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2786    1.8286    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0370    0.9858    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9641    0.8295    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4738    0.1026    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2007   -0.3877    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9883   -1.6279    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7152   -2.1182    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2055   -1.3913    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -0.6934    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8941   -2.0018    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5032   -2.6325    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1339   -2.0234    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  1  0  0  0  0
  1 12  1  0  0  0  0
  1 30  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2  9  1  0  0  0  0
  2 10  1  0  0  0  0
  3  5  1  0  0  0  0
  3 11  1  0  0  0  0
  4  6  1  0  0  0  0
  4  7  1  0  0  0  0
  4 13  1  0  0  0  0
  5  6  1  0  0  0  0
  5  8  1  0  0  0  0
  5 14  1  0  0  0  0
  6 15  1  0  0  0  0
  6 16  1  0  0  0  0
  7  8  1  0  0  0  0
  7 17  1  0  0  0  0
  7 18  1  0  0  0  0
  8 19  1  0  0  0  0
  8 20  1  0  0  0  0
  9 21  1  0  0  0  0
  9 22  1  0  0  0  0
  9 23  1  0  0  0  0
 10 24  1  0  0  0  0
 10 25  1  0  0  0  0
 10 26  1  0  0  0  0
 11 27  1  0  0  0  0
 11 28  1  0  0  0  0
 11 29  1  0  0  0  0
 12 31  1  0  0  0  0
 12 32  1  0  0  0  0
 12 33  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_CID>
4032

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
197

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
1

> <PUBCHEM_CACTVS_HBOND_DONOR>
1

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
1

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADceByAAAAAAAAAAAAAAAAAAAAAYMAAAAwAAAAAAAAAAAAAAAAHAAQAAAAD4iBAAQCAALAAAAAAAAAAAAAAAAAAAAAAIAIAAAAAAIAgAAEAAAAEAAAAAEQgMAPgAAAAAAAAAAAAASAACQAASAACQAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
N,2,3,3-tetramethylnorbornan-2-amine

> <PUBCHEM_IUPAC_CAS_NAME>
N,2,3,3-tetramethyl-2-bicyclo[2.2.1]heptanamine

> <PUBCHEM_IUPAC_NAME_MARKUP>
<I>N</I>,2,3,3-tetramethylbicyclo[2.2.1]heptan-2-amine

> <PUBCHEM_IUPAC_NAME>
N,2,3,3-tetramethylbicyclo[2.2.1]heptan-2-amine

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
N,2,3,3-tetramethylbicyclo[2.2.1]heptan-2-amine

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
methyl-(2,3,3-trimethylnorbornan-2-yl)amine

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/C11H21N/c1-10(2)8-5-6-9(7-8)11(10,3)12-4/h8-9,12H,5-7H2,1-4H3

> <PUBCHEM_IUPAC_INCHIKEY>
IMYZQPCYWPFTAG-UHFFFAOYSA-N

> <PUBCHEM_XLOGP3_AA>
2.6

> <PUBCHEM_EXACT_MASS>
167.167399674

> <PUBCHEM_MOLECULAR_FORMULA>
C11H21N

> <PUBCHEM_MOLECULAR_WEIGHT>
167.29

> <PUBCHEM_OPENEYE_CAN_SMILES>
CC1(C2CCC(C2)C1(C)NC)C

> <PUBCHEM_OPENEYE_ISO_SMILES>
CC1(C2CCC(C2)C1(C)NC)C

> <PUBCHEM_CACTVS_TPSA>
12

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
167.167399674

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
12

> <PUBCHEM_ATOM_DEF_STEREO_COUNT>
0

> <PUBCHEM_ATOM_UDEF_STEREO_COUNT>
3

> <PUBCHEM_BOND_DEF_STEREO_COUNT>
0

> <PUBCHEM_BOND_UDEF_STEREO_COUNT>
0

> <PUBCHEM_ISOTOPIC_ATOM_COUNT>
0

> <PUBCHEM_COMPONENT_COUNT>
1

> <PUBCHEM_CACTVS_TAUTO_COUNT>
-1

> <PUBCHEM_COORDINATE_TYPE>
1
5
255

> <PUBCHEM_BONDANNOTATIONS>
3  11  3
4  7  3
5  8  3

$$$$