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
-2.2703 -0.2283 0.2993 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9604 -0.5003 -0.2984 N 0 0 0 0 0 0 0 0 0 0 0 0
0.2007 0.1757 0.1635 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0947 1.0254 1.1068 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4808 -0.1205 -0.4533 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5475 0.4983 -0.0315 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4502 0.8865 0.2759 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3328 -0.5486 1.3410 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0181 -0.6754 -0.3745 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8375 -1.1894 -1.0719 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5580 -0.8384 -1.2475 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4813 1.2164 0.7604 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5064 0.2985 -0.4696 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