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
   -1.1352    1.2829   -1.0849 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5938    1.3178    0.3142 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1604    0.0517    0.8104 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1838   -0.3432    0.5916 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6035   -1.4684    1.0321 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1728    0.4474   -0.1190 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4167    0.0543   -0.3056 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0666   -0.8124    1.5200 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8048   -1.7604    0.6016 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1793    0.9582   -1.1427 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4430    0.6859   -1.7184 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0868    2.3201   -1.4782 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4185    1.6615    1.0083 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2163    2.0438    0.4028 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8755    1.4008   -0.5154 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6870   -0.9161    0.1050 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1077    0.6779   -0.8384 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4780   -1.4483    2.2207 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8308   -0.2295    2.0607 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7729   -1.2984    0.3134 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0477   -2.7252    1.0866 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2452   -1.9001   -0.3533 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