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
   -1.9984   -1.5417    0.3207 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3147   -0.5987    1.2577 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1297    0.0324    0.6038 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0845   -0.6375    0.7429 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0612   -1.7327    1.5148 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3703   -0.3909    0.2198 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7453    0.5580   -0.5789 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3117    1.2691   -0.0547 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5722    1.1971   -1.5337 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0808   -2.5804    0.7512 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0766   -1.2199    0.2124 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5035   -1.6494   -0.6453 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9627    0.2185    1.6316 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9877   -1.1794    2.1438 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1776   -1.1221    0.5454 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2004    1.3555   -1.0234 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8372    0.5886   -0.8895 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2363    1.7809    0.4016 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4976    1.9762    0.1512 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0782    0.4249   -2.0261 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6334    1.0830   -1.7712 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2449    2.1685   -1.9741 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