Monomers
N,N-Dimethylacrylamide
Identifiers
IUPAC name
N,N-dimethylprop-2-enamide
InchI
InChI=1S/C5H9NO/c1-4-5(7)6(2)3/h4H,1H2,2-3H3
InchI Key
YLGYACDQVQQZSW-UHFFFAOYSA-N
SMILES
C=CC(=O)N(C)C
Canonical SMILES
CN(C)C(=O)C=C
Isomeric SMILES
CN(C)C(=O)C=C
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C5H9NO
Heavy Atom Count
7
Molecular Weight
99.133
Exact Molecular Weight
99.0684
Valence Electrons
40
Radical Electrons
0
tPSA
20.31
MolLogP
0.2606
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
16 15 0 0 0 0 0 0 0 0999 V2000
2.8168 -0.0424 0.4354 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5543 -0.3850 0.4120 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5677 0.5137 -0.1614 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9149 1.6159 -0.6351 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7760 0.1276 -0.1759 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.2680 -1.1247 0.3492 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7741 1.0360 -0.7582 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1300 0.8868 0.0394 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5617 -0.7009 0.8589 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2620 -1.3528 0.8291 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7160 -1.3093 1.3088 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3403 -1.0702 0.5311 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9617 -1.9143 -0.3654 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5140 0.4140 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2853 1.6928 -1.5093 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1720 1.6128 0.1054 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 3
2 3 1 0
3 4 2 0
3 5 1 0
5 6 1 0
5 7 1 0
1 8 1 0
1 9 1 0
2 10 1 0
6 11 1 0
6 12 1 0
6 13 1 0
7 14 1 0
7 15 1 0
7 16 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers