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
   -0.7774    1.0891   -2.0415 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3377    1.5255   -1.0976 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3418    0.5468   -0.0064 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1580   -0.5908   -0.1604 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8558   -0.7234   -1.2004 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1973   -1.6050    0.8677 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9709   -2.6723    0.7167 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4620    0.7689    1.1800 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8298    0.1736    1.0960 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6718    1.5231   -3.0421 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7318    1.4093   -1.5334 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8333   -0.0080   -2.1260 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1571    2.5231   -0.6860 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2809    1.4895   -1.6805 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5964   -1.4884    1.7454 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5531   -2.7490   -0.1812 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0030   -3.4392    1.4902 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6154    1.8773    1.2907 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0569    0.3871    2.0708 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6530    0.9270    1.1450 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9430   -0.4654    0.1912 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9915   -0.4989    1.9619 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