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
   -1.0350    1.3492    1.0065 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0982    0.1903    1.2807 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2024   -0.6087    0.1395 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2281   -0.3717   -0.7536 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3507   -1.2900   -1.6816 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1968    0.6760   -0.8854 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3403    1.7437   -0.1574 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6876   -1.7708   -0.0741 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8667   -1.3839   -0.9264 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8723    2.1445    1.7656 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7972    1.8290    0.0127 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0889    1.0617    1.0052 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7133   -0.4991    1.9844 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7319    0.5094    1.9015 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9603    0.5999   -1.7270 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7394    2.0148    0.6765 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1433    2.4582   -0.3902 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0654   -2.1686    0.8728 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0957   -2.5353   -0.5760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3217   -2.3106   -1.3333 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6723   -0.8743   -0.3430 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5790   -0.7637   -1.7975 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