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
2.3753 1.6418 -0.1814 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2383 1.1218 0.2177 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5781 0.0270 -0.4991 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1512 -0.4023 -1.5274 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.6501 -0.5083 -0.0364 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.2253 -1.5875 -0.8099 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3432 -0.0546 1.1283 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8138 2.4460 0.3868 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8481 1.2614 -1.0614 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7590 1.5047 1.1066 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4591 -1.1537 -1.8226 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1331 -2.0012 -0.3641 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4633 -2.3983 -0.9501 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4084 -0.3439 1.0696 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2083 1.0253 1.3339 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8729 -0.5783 2.0095 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