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
2.2904 -0.3003 0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0230 0.0726 -0.4195 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.2140 -0.0458 0.2513 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1997 -0.5055 1.4400 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4618 0.3320 -0.3624 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6055 0.2163 0.2736 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1081 0.3786 -0.0503 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5732 -1.3431 -0.1388 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1241 -0.3219 1.2773 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0441 0.4423 -1.3851 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4637 0.7191 -1.3661 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5089 0.5134 -0.2317 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7093 -0.1578 1.2746 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