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
   -2.3941    0.5522    0.8474 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7060    0.2364   -0.4444 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3087   -0.0601   -0.2918 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6543    0.9734   -0.3625 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3039    2.1895   -0.5711 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0775    0.7453   -0.2082 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9169    1.7494   -0.2867 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1123   -1.4110   -0.0733 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1916   -1.7674    1.3956 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4707    1.6424    1.0294 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4365    0.1742    0.7967 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8831    0.0123    1.6604 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8253    1.0372   -1.2062 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1952   -0.6750   -0.8829 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3970   -0.2770   -0.0268 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9705    1.5638   -0.1700 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5196    2.7326   -0.4667 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0532   -1.6481   -0.6111 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6318   -2.1532   -0.5021 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4936   -0.9158    2.0311 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9454   -2.5818    1.5293 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7843   -2.1194    1.7466 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