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
2.7509 0.6906 -0.5397 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4954 0.7278 -0.1541 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5937 -0.4059 -0.3208 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0583 -1.4431 -0.8548 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7570 -0.3068 0.1166 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.6006 -1.4763 -0.0808 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2855 0.8896 0.7303 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1095 -0.2206 -0.9942 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3878 1.5459 -0.4012 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1379 1.6391 0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4644 -2.2300 0.6943 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6755 -1.1772 -0.0608 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3916 -1.8567 -1.1139 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7612 1.1263 1.6921 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3594 0.7292 0.9529 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2383 1.7680 0.0340 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