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
2.8785 0.0925 -0.0385 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6215 0.2908 -0.3659 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5199 -0.0607 0.5146 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7982 -0.5729 1.6279 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8292 0.1642 0.1363 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.9051 -0.1972 1.0364 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1325 0.7562 -1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6554 0.3714 -0.7285 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1808 -0.3435 0.9034 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3834 0.7296 -1.3199 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6439 -0.0050 2.0995 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2111 -1.2517 0.9337 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8256 0.4071 0.8024 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1950 0.9774 -1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5328 1.7123 -1.1886 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7626 0.1423 -1.9988 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