Monomers
N,N-Dimethylacrylamide
Identifiers
IUPAC name
N,N-dimethylprop-2-enamide
InchI
InChI=1S/C5H9NO/c1-4-5(7)6(2)3/h4H,1H2,2-3H3
InchI Key
YLGYACDQVQQZSW-UHFFFAOYSA-N
SMILES
C=CC(=O)N(C)C
Canonical SMILES
CN(C)C(=O)C=C
Isomeric SMILES
CN(C)C(=O)C=C
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C5H9NO
Heavy Atom Count
7
Molecular Weight
99.133
Exact Molecular Weight
99.0684
Valence Electrons
40
Radical Electrons
0
tPSA
20.31
MolLogP
0.2606
H Bond Acceptors
1
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
16 15 0 0 0 0 0 0 0 0999 V2000
2.8494 0.1306 -0.1208 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5749 0.2592 -0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5722 -0.2542 0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8853 -0.8323 1.5710 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7981 -0.1034 0.1666 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.8440 -0.6056 1.0467 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1645 0.5548 -1.0552 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1293 -0.3606 0.7927 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6231 0.5019 -0.7725 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2947 0.7510 -1.3218 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5249 -1.4778 1.6215 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7201 -0.8734 0.4317 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1322 0.2088 1.7177 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2495 0.7358 -1.0615 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5921 1.5127 -1.2128 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9034 -0.1474 -1.8933 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 3
2 3 1 0
3 4 2 0
3 5 1 0
5 6 1 0
5 7 1 0
1 8 1 0
1 9 1 0
2 10 1 0
6 11 1 0
6 12 1 0
6 13 1 0
7 14 1 0
7 15 1 0
7 16 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers