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
2.1628 0.1460 0.1812 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7242 0.3067 -0.0831 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.2095 -0.6547 0.3513 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2593 -1.6663 0.9827 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6365 -0.5641 0.1282 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1579 0.4413 -0.5062 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4285 -0.8884 0.3786 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6579 0.5243 -0.7585 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5023 0.8411 0.9794 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3744 1.1393 -0.5986 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3214 -1.3511 0.4933 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5616 1.2377 -0.8873 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2224 0.4884 -0.6609 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