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
2.1563 0.0651 0.1952 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7260 0.2153 -0.0751 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.2425 -0.6148 0.5160 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1172 -1.5119 1.2979 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6383 -0.4420 0.2304 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0935 0.4802 -0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6824 -0.3393 -0.6898 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5293 1.0793 0.4285 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2629 -0.5857 1.0929 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5009 0.9967 -0.7473 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3807 -1.0987 0.7004 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4694 1.1852 -1.1043 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1505 0.5705 -0.7646 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