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
   -1.3138    2.3515   -0.3932 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0570    1.3076    0.6752 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2518    0.2276    0.1828 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1528    0.2993    0.2842 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6938    1.3063    0.7973 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9955   -0.7746   -0.1952 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3064   -0.6968   -0.0966 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8837   -0.9099   -0.4104 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1951   -2.0058    0.6047 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4892    1.8666   -1.3827 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1874    2.9426   -0.0471 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4577    3.0567   -0.4141 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0398    0.9748    1.0460 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5422    1.8508    1.5132 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5852   -1.6571   -0.6388 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7418    0.1743    0.3445 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9643   -1.4732   -0.4409 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3156   -1.3805   -1.2358 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8258   -0.5491   -0.8939 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4550   -1.6071    1.5836 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0625   -2.5736    0.1755 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3630   -2.7304    0.6875 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