Structure #1
  Mrv1652309042000402D          

  6  6  0  0  0  0            999 V2000
    0.5678    1.9390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9800   -0.1553    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1553   -0.1553    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2349    0.6294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0997    0.6294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5678    1.1140    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
  1  6  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  4  6  2  0  0  0  0
  5  6  1  0  0  0  0
M  CHG  1   6   1
M  END
> <DATABASE_ID>
FDB112411

> <DATABASE_NAME>
foodb

> <SMILES>
C[N+]1=CCCC1

> <INCHI_IDENTIFIER>
InChI=1S/C5H10N/c1-6-4-2-3-5-6/h4H,2-3,5H2,1H3/q+1

> <INCHI_KEY>
FDWZAOGDOVQOLD-UHFFFAOYSA-N

> <FORMULA>
C5H10N

> <MOLECULAR_WEIGHT>
84.1396

> <EXACT_MASS>
84.081324325

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_ATOM_COUNT>
16

> <JCHEM_AVERAGE_POLARIZABILITY>
10.24345808612234

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
1

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
1-methyl-3,4-dihydro-2H-pyrrol-1-ium

> <ALOGPS_LOGP>
-2.38

> <JCHEM_LOGP>
-3.435087665471746

> <ALOGPS_LOGS>
-2.85

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
1

> <JCHEM_PHYSIOLOGICAL_CHARGE>
1

> <JCHEM_POLAR_SURFACE_AREA>
3.01

> <JCHEM_REFRACTIVITY>
37.678999999999995

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
1.71e-01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
N-methylpyrrolinium

> <JCHEM_VEBER_RULE>
1

> <FOODB_ID>
FDB112411

> <GENERIC_NAME>
1-Methylpyrrolinium

$$$$