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
   -0.0760    1.9929    1.3043 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3053    1.3120    0.0159 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3337   -0.1095    0.0920 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8169   -0.8828   -0.1732 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7336   -2.1542   -0.1059 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0622   -0.2316   -0.5134 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1431   -0.9442   -0.7659 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5752   -0.7973    0.4517 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3627   -1.1007   -0.7897 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1344    1.8280    1.5835 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0650    3.0895    1.1363 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5428    1.7156    2.1578 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3214    1.7420   -0.2401 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3500    1.6883   -0.7816 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1165    0.8308   -0.5587 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0845   -0.5024   -1.0213 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1145   -2.0304   -0.7222 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1410   -0.2336    1.2138 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3003   -1.7656    0.9199 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8898   -2.0457   -0.6542 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6591   -1.0945   -1.6583 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1353   -0.3068   -0.8909 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