Monomers
N-Methylacrylamide
Identifiers
IUPAC name
N-methylprop-2-enamide
InchI
InChI=1S/C4H7NO/c1-3-4(6)5-2/h3H,1H2,2H3,(H,5,6)
InchI Key
YPHQUSNPXDGUHL-UHFFFAOYSA-N
SMILES
CNC(=O)C=C
Canonical SMILES
CNC(=O)C=C
Isomeric SMILES
CNC(=O)C=C
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C4H7NO
Heavy Atom Count
6
Molecular Weight
85.106
Exact Molecular Weight
85.0528
Valence Electrons
34
Radical Electrons
0
tPSA
29.1
MolLogP
-0.0816
H Bond Acceptors
1
H Bond Donors
1
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
13 12 0 0 0 0 0 0 0 0999 V2000
2.1259 0.1891 0.1865 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6877 0.1479 0.3577 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.1199 -0.2520 -0.7395 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4660 -0.5515 -1.8111 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5780 -0.3095 -0.6158 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2116 -0.0025 0.4896 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5374 1.1307 0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3548 0.2908 -0.8957 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6119 -0.6868 0.6561 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2946 0.4122 1.2773 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1460 -0.6190 -1.4769 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2873 -0.0658 0.5149 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7355 0.3166 1.4007 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 2 0
3 5 1 0
5 6 2 3
1 7 1 0
1 8 1 0
1 9 1 0
2 10 1 0
5 11 1 0
6 12 1 0
6 13 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers