Compound 76
  CheckMol                        TMF02:r0:m0
MF=C9H13N MW=135.21
 10 10  0  1  0               999 V2000
    0.0000   -0.0000   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3098    0.7552   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2862    0.7552   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0118   -1.4868   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6195    0.0236   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.9293    0.7906   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6313   -1.4632   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -5.2390    0.0590   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.9411   -2.1947   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -5.2508   -1.4278   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  5  6 02  0  1  0  0
  5  7 01  0  1  0  0
  6  8 01  0  1  0  0
  7  9 02  0  1  0  0
  8 10 02  0  1  0  0
  9 10 01  0  1  0  0
M  END

2D Structure

Dimethylbenzylamine

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Chemical Name - Dimethylbenzylamine
Mol Weight - 135.209
Smiles - CN(C)Cc1ccccc1

Property Name	Property Value
Mol Name	Dimethylbenzylamine
Molweight	135.209
Monoisotopic Mass	135.104799
Clogp	1.2825
Clogs	-1.13
H Acceptors	1
Total Surface Area	121.84
Relative Psa	0.029137
Polar Surface Area	3.24
Druglikeness	2.08
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	high
Shape Index	0.7
Molecular Flexibility	0.47562
Molecular Complexity	0.49698
Fragments	1
Non H Atoms	10
Non Ch Atoms	1
Electronegative Atoms	1
Rotatable Bonds	2
Rings Closures	1
Small Rings	1
Aromatic Rings	1
Aromatic Atoms	6
Sp3 Atoms	4
Symmetric Atoms	3
Amines	1
Alkyl Amines	1
Basic Nitrogens	1
Smiles	CN(C)Cc1ccccc1
InChIKey	InChI=1S/C9H13N/c1-10(2)8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3
InChI	XXBDWLFCJWSEKW-UHFFFAOYSA-N

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1 — Dimethylbenzylamine | 2 — Dimethylbenzylamine