Monomers
N-Phenylmethacrylamide
Identifiers
IUPAC name
2-methyl-N-phenylprop-2-enamide
InchI
InChI=1S/C10H11NO/c1-8(2)10(12)11-9-6-4-3-5-7-9/h3-7H,1H2,2H3,(H,11,12)
InchI Key
IJSVVICYGLOZHA-UHFFFAOYSA-N
SMILES
O=C(C(=C)C)Nc1ccccc1
Canonical SMILES
CC(=C)C(=O)NC1=CC=CC=C1
Isomeric SMILES
CC(=C)C(=O)NC1=CC=CC=C1
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C10H11NO
Heavy Atom Count
12
Molecular Weight
161.204
Exact Molecular Weight
161.0841
Valence Electrons
62
Radical Electrons
0
tPSA
29.1
MolLogP
2.2012
H Bond Acceptors
1
H Bond Donors
1
Aliphatic Carbocycles
0
Aromatic Carbocycles
1
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
1
MOL File
RDKit 3D
23 23 0 0 0 0 0 0 0 0999 V2000
0.7070 -1.9572 -0.0224 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1877 -0.8006 -0.0263 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6388 -0.6682 -0.0515 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3937 -1.7506 -0.0693 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2233 0.6877 -0.0564 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3564 0.3316 -0.0069 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.0649 0.3013 0.0142 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7538 1.5138 0.2148 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1238 1.5528 0.2349 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9066 0.4359 0.0645 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2537 -0.7567 -0.1328 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8503 -0.8039 -0.1547 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9870 -2.7448 -0.0661 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4817 -1.6744 -0.0883 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3328 0.5975 -0.1419 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7807 1.2832 -0.8776 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9814 1.1565 0.9299 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8676 1.2571 -0.0106 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1410 2.3919 0.3491 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6055 2.5077 0.3924 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.9659 0.5381 0.0916 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8647 -1.6336 -0.2667 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4079 -1.7650 -0.3199 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0
2 3 1 0
3 4 2 3
3 5 1 0
2 6 1 0
6 7 1 0
7 8 2 0
8 9 1 0
9 10 2 0
10 11 1 0
11 12 2 0
12 7 1 0
4 13 1 0
4 14 1 0
5 15 1 0
5 16 1 0
5 17 1 0
6 18 1 0
8 19 1 0
9 20 1 0
10 21 1 0
11 22 1 0
12 23 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers