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
    0.5642    2.2770    0.1479 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0521    1.1610   -0.7373 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3373    0.0306    0.0812 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6158   -0.9484    0.3833 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2606   -1.9270    1.0901 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9884   -0.9008   -0.0703 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -1.8427    0.2337 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7064   -0.0367    0.5566 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6039   -0.7727   -0.4087 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1011    3.1510   -0.0014 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5560    1.9845    1.2321 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6000    2.5712   -0.1176 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7784    0.8740   -1.5154 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8810    1.4842   -1.2881 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3390   -0.0813   -0.6752 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5510   -2.6897    0.8438 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8849   -1.8319   -0.0906 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7497   -0.5686    1.5329 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1250    0.9617    0.7045 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5822   -0.9151    0.1062 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7937   -0.2053   -1.3344 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1682   -1.7752   -0.6733 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