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
1.9850 0.3286 -0.6081 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5698 0.2948 -0.2749 N 0 0 0 0 0 0 0 0 0 0 0 0
0.0651 -0.5118 0.7786 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9209 -1.1972 1.4074 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3560 -0.5635 1.1341 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2765 0.1244 0.5159 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3339 1.3698 -0.6255 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1980 -0.1184 -1.5948 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5989 -0.2121 0.1388 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0592 0.8790 -0.8315 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6704 -1.2113 1.9614 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2982 0.0497 0.8156 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0113 0.7680 -0.2963 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