Chem 44 Dimethyl 2 Phenyl 13 Oxazolidine Dsrpl

Compound 235
  CheckMol                        TMF02:r0:m0
MF=C11H15NO MW=177.25
 13 14  0  2  0               999 V2000
    0.0000   -0.0000   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3770    0.6238   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9886    1.1181   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2358    2.1185   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6834   -0.1059   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    0.2354    2.4245   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9898    0.6591   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6952   -1.5889   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.4359    3.3190   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0706    3.9192   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2962   -0.0706   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -4.0016   -2.3186   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -5.3080   -1.5536   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  1  0  0
  1  3  1  0  1  0  0
  2  4  1  0  1  0  0
  2  5  1  0  0  0  0
  3  6  1  0  1  0  0
  5  7 02  0  1  0  0
  5  8 01  0  1  0  0
  6  9  1  0  0  0  0
  6 10  1  0  0  0  0
  7 11 01  0  1  0  0
  8 12 02  0  1  0  0
 11 13 02  0  1  0  0
  4  6  1  0  1  0  0
 12 13 01  0  1  0  0
M  END

4,4-Dimethyl-2-phenyl-1,3-oxazolidine

₹ 0.00 0.00

Chemical Name - 4,4-Dimethyl-2-phenyl-1,3-oxazolidine
Mol Weight - 177.246
Smiles - CC1(C)NC(c2ccccc2)OC1

Property Name	Property Value
Mol Name	4,4-Dimethyl-2-phenyl-1,3-oxazolidine
Molweight	177.246
Monoisotopic Mass	177.115364
Clogp	1.4945
Clogs	-1.934
H Acceptors	2
H Donors	1
Total Surface Area	142.41
Relative Psa	0.15069
Polar Surface Area	21.26
Druglikeness	-0.68492
Mutagenic	low
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Shape Index	0.61538
Molecular Flexibility	0.31314
Molecular Complexity	0.57758
Fragments	1
Non H Atoms	13
Non Ch Atoms	2
Electronegative Atoms	2
Stereo Centers	1
Rotatable Bonds	1
Rings Closures	2
Small Rings	2
Aromatic Rings	1
Aromatic Atoms	6
Sp3 Atoms	7
Symmetric Atoms	3
Basic Nitrogens	1
Smiles	CC1(C)NC(c2ccccc2)OC1
InChIKey	InChI=1S/C11H15NO/c1-11(2)8-13-10(12-11)9-6-4-3-5-7-9/h3-7,10,12H,8H2,1-2H3
InChI	ZYUWGAVXDLKUKT-UHFFFAOYSA-N

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4,4-Dimethyl-2-phenyl-1,3-oxazolidine