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
2.1089 0.2756 -0.3102 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6689 0.3947 -0.0434 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.0796 -0.7506 0.2588 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5180 -1.8804 0.2944 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4935 -0.6939 0.5289 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2234 0.3820 0.5266 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3377 0.4982 -1.3749 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5892 1.0846 0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4403 -0.7186 -0.0247 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1993 1.3213 -0.0767 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0180 -1.6307 0.7589 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7654 1.3313 0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2824 0.3865 0.7340 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