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
   -2.0510    1.4816   -0.2535 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8734    0.1358    0.3641 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4356   -0.2745    0.3701 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3575    0.0521    1.4713 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2956    0.6231    2.4410 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7514   -0.1360    1.6996 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6976   -0.6309    0.9662 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0557   -1.0294   -0.7989 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5468   -0.2176   -1.8996 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2460    1.3542   -1.3316 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0546    2.0049   -0.1913 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8392    2.0908    0.2340 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4048   -0.6092   -0.2353 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2257    0.0739    1.4122 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1668    0.2005    2.7184 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5555   -1.0029   -0.0076 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7081   -0.6803    1.3467 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6190   -1.8473   -0.5077 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0240   -1.5019   -1.1951 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2700    0.1162   -2.5732 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1230    0.6591   -1.5427 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2498   -0.8624   -2.4871 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