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
-2.2838 0.8304 0.5163 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8499 -0.3905 0.6428 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5229 -0.9062 0.4823 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3807 -2.1942 0.6756 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6590 -0.2296 0.1454 N 0 0 0 0 0 0 0 0 0 0 0 0
1.8989 -1.0057 0.0479 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7932 1.1754 -0.1223 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6979 1.6904 0.2604 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3681 1.0465 0.6823 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6336 -1.1294 0.9151 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7168 -2.0715 -0.0922 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5262 -0.6565 -0.8009 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4984 -0.8893 0.9879 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2181 1.4843 -1.0233 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8627 1.4240 -0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5638 1.8219 0.7507 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