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
   -0.5276    1.7639   -1.2625 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8027    0.8248   -0.1659 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0546   -0.3704   -0.0853 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1691   -0.4437    0.6011 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7644   -1.6228    0.6638 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9435    0.5579    1.2825 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7352    1.8339    1.4432 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5046   -1.6207   -0.7184 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3444   -2.4062    0.2617 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5357    1.9978   -1.4472 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0094    2.7461   -1.0106 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0083    1.4475   -2.2179 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9471    1.2661    0.8295 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8859    0.4542   -0.3963 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9072    0.2255    1.7796 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5146    2.3820    2.0279 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9237    2.4137    1.0798 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4061   -2.1529   -1.0429 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1201   -1.4345   -1.6042 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9253   -1.7321    0.9239 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6972   -3.0784    0.8801 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0723   -3.0518   -0.2926 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