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Molecule
N-[3-(Dimethylamino)Propyl]Methacrylamide
CAS: 5205-93-6 · C9H18N2O
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 5205-93-6
- Molecular Formula
- C9H18N2O
- Molecular Mass
- 170.26 g/mol
Identifiers
CAS Registry Number
5205-93-6
SMILES
C=C(C)C(O)=NCCCN(C)C
InChI Key
GDFCSMCGLZFNFY-UHFFFAOYSA-N
InChI
InChI=1S/C9H18N2O/c1-8(2)9(12)10-6-5-7-11(3)4/h1,5-7H2,2-4H3,(H,10,12)
Names and Synonyms
- N-[3-(Dimethylamino)Propyl]Methacrylamide Common Name
- 2-Propenamide, N-[3-(dimethylamino)propyl]-2-methyl- Synonym
- Acrylamide, N-[3-(dimethylamino)propyl]-2-methyl- Synonym
- N-[3-(Dimethylamino)propyl]-2-methyl-2-propenamide Synonym
- N-[3-(Dimethylamino)propyl]methacrylamide Synonym
- N-[3-(N,N-Dimethylamino)propyl]methacrylamide Synonym
- Mhoromer BM 611 Synonym
- Dimethyl[3-(methacryloylamino)propyl]amine Synonym
- N,N-Dimethylaminopropyl methacrylamide Synonym
- DMAPMA Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 170.26 g/mol | CAS Common Chemistry |
| 170.25599999999997 g/mol | RDKit | |
| 170.256 g/mol | RDKit | |
| Boiling Point | 71-80 °C @ Press: 5 x 10-3 Torr | CAS Common Chemistry |
| Canonical SMILES | O=C(NCCCN(C)C)C(=C)C | CAS Common Chemistry |
| InChI | InChI=1S/C9H18N2O/c1-8(2)9(12)10-6-5-7-11(3)4/h1,5-7H2,2-4H3,(H,10,12) | CAS Common Chemistry |
| InChI Key | InChIKey=GDFCSMCGLZFNFY-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 62.0-63.0 °C @ Solvent: Ethyl acetate | CAS Common Chemistry |
| Name | N-[3-(Dimethylamino)propyl]methacrylamide | CAS Common Chemistry |
| Heavy Atom Count | 12 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 5 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 35.830000000000005 Ų | RDKit |
| 35.83 Ų | RDKit | |
| 35.6 Ų | chempirical lib | |
| LogP | 1.4707 | RDKit |
| Molar Refractivity | 52.91580000000004 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.6667 | RDKit |
| 0.67 | chempirical lib | |
| Exact Mass | 170.141913196 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
9
8
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5
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3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
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40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
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Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
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MW = 170.26 g/mol. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C9H18N2O.
