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
2.3154 0.0665 -0.1951 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9710 -0.5068 -0.0460 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.2033 0.2345 -0.2582 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1424 1.4383 -0.5896 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5028 -0.4014 -0.0916 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5847 0.3217 -0.2981 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9582 -0.7503 -0.5559 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3019 0.9285 -0.8833 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6526 0.3966 0.8101 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8794 -1.5042 0.2283 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5837 -1.4504 0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5053 1.3501 -0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5564 -0.1231 -0.1820 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