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
2.1268 0.2943 -0.2156 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6763 0.3571 0.0220 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.1462 -0.7460 -0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3708 -1.8318 -0.7127 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5713 -0.6834 -0.0152 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1309 0.3922 0.4511 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5944 0.7114 0.7026 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3858 -0.7753 -0.3288 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3571 0.8949 -1.1175 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3339 1.2489 0.3905 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2119 -1.5695 -0.2359 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2131 0.4438 0.6301 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5716 1.2634 0.6785 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