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
-2.0891 0.0256 -0.6208 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6936 -0.2757 -0.2990 N 0 0 0 0 0 0 0 0 0 0 0 0
0.1683 0.6910 0.2702 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3311 1.8479 0.4922 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5532 0.4734 0.6156 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1241 -0.6810 0.4159 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6279 -0.9440 -0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5345 0.7163 0.1251 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1644 0.4083 -1.6593 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3001 -1.2219 -0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1319 1.2774 1.0476 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6039 -1.5158 -0.0083 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1595 -0.8015 0.6878 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