Monomers

N,N-Diethylacrylamide

Identifiers

IUPAC name
N,N-diethylprop-2-enamide
InchI
InChI=1S/C7H13NO/c1-4-7(9)8(5-2)6-3/h4H,1,5-6H2,2-3H3
InchI Key
OVHHHVAVHBHXAK-UHFFFAOYSA-N
SMILES
CCN(C(=O)C=C)CC
Canonical SMILES
CCN(CC)C(=O)C=C
Isomeric SMILES
CCN(CC)C(=O)C=C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C7H13NO
Heavy Atom Count
9
Molecular Weight
127.187
Exact Molecular Weight
127.0997
Valence Electrons
52
Radical Electrons
0
tPSA
20.31
MolLogP
1.0408
H Bond Acceptors
1
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0

MOL File


     RDKit          3D

 22 21  0  0  0  0  0  0  0  0999 V2000
   -0.5880    2.6011    0.6908 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8697    1.1536    1.0420 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2352    0.2339    0.1507 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0704   -0.2441    0.4251 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6474    0.1821    1.4830 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7721   -1.1893   -0.4379 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9932   -1.5483   -0.0544 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9058   -0.2195   -1.0430 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7036   -1.4878   -0.7735 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8390    3.1973    1.5960 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2238    2.8757   -0.1775 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4903    2.6819    0.4815 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9739    1.0146    1.1043 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5043    1.0260    2.1028 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3321   -1.5849   -1.3429 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5461   -2.2496   -0.6708 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4633   -1.1756    0.8424 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5894    0.5825   -1.4533 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2243   -0.4384   -1.8839 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4968   -2.2786   -1.5211 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3886   -1.9201    0.2144 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7724   -1.2125   -0.7746 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  2  0
  4  6  1  0
  6  7  2  3
  3  8  1  0
  8  9  1  0
  1 10  1  0
  1 11  1  0
  1 12  1  0
  2 13  1  0
  2 14  1  0
  6 15  1  0
  7 16  1  0
  7 17  1  0
  8 18  1  0
  8 19  1  0
  9 20  1  0
  9 21  1  0
  9 22  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers