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Compound 90
  CheckMol                        TMF02:r0:m0
MF=C14H15N MW=197.28
 15 16  0  2  0               999 V2000
    0.0000   -0.0000   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2904    0.7577   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3141    0.7577   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5809    0.0237   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6282    0.0237   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    2.5690   -1.4680   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    3.8713    0.7814   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.9423    0.7932   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6401   -1.4680   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    3.8595   -2.2139   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    5.1617    0.0355   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -5.2564    0.0592   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.9542   -2.2020   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    5.1499   -1.4562   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -5.2683   -1.4325   -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
  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  4  6 02  0  1  0  0
  4  7 01  0  1  0  0
  5  8 02  0  1  0  0
  5  9 01  0  1  0  0
  6 10 01  0  1  0  0
  7 11 02  0  1  0  0
  8 12 01  0  1  0  0
  9 13 02  0  1  0  0
 10 14 02  0  1  0  0
 12 15 02  0  1  0  0
 11 14 01  0  1  0  0
 13 15 01  0  1  0  0
M  END

Dibenzylamine

₹ 0.00 0.00

Chemical Name - Dibenzylamine
Mol Weight - 197.28
Smiles - C(c1ccccc1)NCc1ccccc1

Property Name	Property Value
Mol Name	Dibenzylamine
Molweight	197.28
Monoisotopic Mass	197.120449
Clogp	2.4341
Clogs	-2.815
H Acceptors	1
H Donors	1
Total Surface Area	172
Relative Psa	0.066628
Polar Surface Area	12.03
Druglikeness	-0.28173
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Shape Index	0.73333
Molecular Flexibility	0.52002
Molecular Complexity	0.38686
Fragments	1
Non H Atoms	15
Non Ch Atoms	1
Electronegative Atoms	1
Rotatable Bonds	4
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3 Atoms	3
Symmetric Atoms	9
Amines	1
Alkyl Amines	1
Basic Nitrogens	1
Smiles	C(c1ccccc1)NCc1ccccc1
InChIKey	InChI=1S/C14H15N/c1-3-7-13(8-4-1)11-15-12-14-9-5-2-6-10-14/h1-10,15H,11-12H2
InChI	BWLUMTFWVZZZND-UHFFFAOYSA-N

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Dibenzylamine