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
-1.7296 1.2908 0.2012 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4242 0.6675 0.2718 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.2096 -0.6118 -0.3127 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1961 -1.1492 -0.8768 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0642 -1.2997 -0.2842 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1464 -0.8253 0.2763 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9551 1.6850 1.2299 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5314 0.5331 0.0117 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7990 2.0918 -0.5348 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3595 1.1567 0.7516 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1122 -2.2790 -0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0514 -1.3925 0.2568 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1112 0.1327 0.7511 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