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
    2.2811   -0.8190    0.6951 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1854   -0.0986    1.4202 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0499    0.2061    0.5384 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9982   -0.7164    0.4095 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9633   -1.7877    1.0578 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1394   -0.4898   -0.4513 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1289   -1.3688   -0.5650 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0385    1.4447   -0.1606 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6747    1.3714   -1.5330 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8991   -1.3370    1.4831 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9154   -1.5931    0.0068 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9886   -0.1234    0.1817 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6076    0.8286    1.8561 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8615   -0.7361    2.2613 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1799    0.4274   -1.0215 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1366   -2.2950   -0.0251 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9379   -1.1151   -1.2299 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9927    1.8249   -0.2652 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5723    2.1890    0.4867 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8747    2.4275   -1.8431 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0653    0.9877   -2.2710 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5935    0.7727   -1.5540 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