Ketcher 06051717052D 1   1.00000     0.00000     0

 12 13  0     0  0            999 V2000
    7.0887   -3.9738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0887   -4.9738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9547   -5.4738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8208   -4.9738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8208   -3.9738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9547   -3.4738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7719   -3.6648    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3595   -4.4738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7719   -5.2828    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.0808   -2.7137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0590   -2.5058    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.3681   -1.5547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0     0  0
  1  6  1  0     0  0
  2  3  1  0     0  0
  3  4  2  0     0  0
  4  5  1  0     0  0
  4  9  1  0     0  0
  5  6  2  0     0  0
  5  7  1  0     0  0
  7  8  2  0     0  0
  7 10  1  0     0  0
  8  9  1  0     0  0
 10 11  1  0     0  0
 11 12  1  0     0  0
M  END
> <ID>
CHEBI:137310

> <NAME>
3-(methylaminomethyl)indole

> <DEFINITION>
An aminoalkylindole that is indole carrying a methylaminomethyl substituent at postion 3.

> <STAR>
3

> <SYNONYM>
NMAMI; N-norgramine; N-methyl-N-(indol-3-ylmethyl)amine; N-methyl-3-aminomethylindole; (indol-3-yl)-N-methylmethanamine; (1H-indol-3-yl)-N-methylmethanamine

> <IUPAC_NAME>
1-(1H-indol-3-yl)-N-methylmethanamine

> <FORMULA>
C10H12N2

> <MASS>
160.216

> <MONOISOTOPIC_MASS>
160.10005

> <CHARGE>
0

> <SMILES>
C1=CC=C2C(=C1)C(=CN2)CNC

> <INCHI>
InChI=1S/C10H12N2/c1-11-6-8-7-12-10-5-3-2-4-9(8)10/h2-5,7,11-12H,6H2,1H3

> <INCHIKEY>
BIFJNBXQXNWYOL-UHFFFAOYSA-N

> <CAS_REGISTRY_NUMBER>
36284-95-4

> <REAXYS_REGISTRY_NUMBER>
472751

> <CHEMIDPLUS>
36284-95-4

> <METACYC_ACCESSION>
CPD-8914

> <PUBMED_CITATION>
16662926; 16664431; 16930646; 7141562

$$$$