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
    2.3673   -0.3430   -1.0625 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7079   -0.6735    0.2183 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3788   -0.1891    0.4057 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6589   -1.0530   -0.0344 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4233   -2.1930   -0.5483 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0940   -0.7241    0.0559 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0187   -1.5524   -0.3600 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0109    1.0569    0.9946 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1489    2.2034    0.0550 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7331   -0.3862   -1.9548 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1726   -1.1065   -1.2271 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9261    0.6284   -0.9874 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7029   -1.7727    0.3561 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3685   -0.2927    1.0413 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4145    0.2181    0.4674 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7618   -2.5144   -0.7877 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0503   -1.2973   -0.2865 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9372    0.9529    1.5524 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7499    1.3931    1.7724 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7017    1.9875   -0.8577 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8394    2.6698   -0.0972 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7481    2.9876    0.5994 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