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
   -0.6262    1.1092    1.6718 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3372    1.3877    0.1927 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2047    0.1537   -0.5538 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0459   -0.4717   -0.6871 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1700   -1.5519   -1.3471 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2577    0.0633   -0.0908 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4264   -0.5326   -0.2240 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4258   -0.3729   -1.1346 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1683   -1.3011   -0.2385 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5780    0.5884    1.8131 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6689    2.1029    2.1696 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1713    0.4756    2.1005 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5682    2.0198    0.1730 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2168    1.9727   -0.1879 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2553    0.9878    0.4999 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3180   -0.1433    0.2119 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4604   -1.4439   -0.7973 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1048   -0.9395   -2.0549 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0359    0.4648   -1.4588 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1386   -0.7988    0.0478 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4943   -2.2170   -0.8047 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6737   -1.5532    0.6993 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