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
   -2.4253   -1.1938   -0.3943 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4506   -0.2159   -0.9661 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3063    0.0158   -0.1442 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8395   -0.8024   -0.3206 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8137   -1.7259   -1.2068 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0529   -0.6603    0.4453 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0890   -1.4455    0.2439 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3312    1.0660    0.8471 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1622    2.3814    0.3027 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9477   -1.9938    0.2034 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0346   -1.6010   -1.2281 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1716   -0.6825    0.2818 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2055   -0.5289   -1.9946 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9960    0.7648   -1.0667 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1042    0.1068    1.1941 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0155   -1.3681    0.7994 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0770   -2.2363   -0.5083 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2572    0.7350    1.7228 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3867    1.2225    1.2244 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6548    2.2131   -0.6622 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8518    2.8325    1.0595 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6621    3.1168    0.1675 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