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Napropamide
CAS: 15299-99-7 | C17H21NO2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
15299-99-7
Molecular Formula:
C17H21NO2
Molecular Mass:
271.36 g/mol
Names and Synonyms:
Napropamide
Propanamide, N,N-diethyl-2-(1-naphthalenyloxy)-
Propionamide, N,N-diethyl-2-(1-naphthyloxy)-
N,N-Diethyl-2-(1-naphthalenyloxy)propanamide
R 7465
2-(α-Naphthoxy)-N,N-diethylpropionamide
Napropamide
Devrinol
Napropamid
N,N-Diethyl-2-(1-naphthalenyloxy)propionamide
Racemic devrinol
(±)-Devrinol
N,N-Diethyl-2-(1-naphthyloxy)propanamide
N,N-Diethyl-2-(1-naphthoxy)propionamide
Identifiers:
SMILES:
CCN(CC)C(=O)C(C)Oc1cccc2ccccc12
InChI:
InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3
Key Properties
Melting Point
75 °C
CAS Common Chemistry
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 271.36 g/mol | CAS Common Chemistry |
| 271.157228912 g/mol | RDKit | |
| Canonical SMILES | O=C(N(CC)CC)C(OC1=CC=CC=2C=CC=CC12)C | CAS Common Chemistry |
| InChI | InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3 | CAS Common Chemistry |
| InChI Key | InChIKey=WXZVAROIGSFCFJ-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 75 °C | CAS Common Chemistry |
| Name | Napropamide | CAS Common Chemistry |
| Heavy Atom Count | 20 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 5 | RDKit |
| Aromatic Ring Count | 2 | RDKit |
| Topological Polar Surface Area | 29.540000000000003 Ų | RDKit |
| LogP | 3.475500000000002 | RDKit |
| Molar Refractivity | 81.96600000000005 | RDKit |
