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
   -0.6307    1.7984   -0.8433 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7736    1.1935    0.5354 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3738   -0.1908    0.5729 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9548   -0.6095    0.8547 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2759   -1.8322    0.8805 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0071    0.3618    1.1270 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2498   -0.0061    1.3915 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3851   -1.1881    0.3075 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4978   -1.5435   -1.1344 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3612    2.6420   -0.8893 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9285    1.0105   -1.5640 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3975    2.1004   -1.0837 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2459    1.7992    1.3093 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8447    1.2422    0.8184 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7930    1.4248    1.1191 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4603   -1.0835    1.3981 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0345    0.7063    1.5942 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1235   -2.0701    0.9574 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3724   -0.8349    0.7263 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3076   -0.9518   -1.6204 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8033   -2.6152   -1.2806 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5249   -1.3535   -1.6349 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