ChemDB: Chemical Search
Download
Chemical ID: 5148809
Chemical ID:
5148809
Name [?]:
N,N-dimethyl-3-phenoxy-propanamide
SMILES [?]:
CN(C)C(=O)CCOc1ccccc1
InChi [?]:
InChI=1/C11H15NO2/c1-12(2)11(13)8-9-14-10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,3,12,11,13,10,14,6,7,9,4,2,5,8/E:(1,2)(4,5)(6,7)/rA:14nCNCCOCCOCCCCCC/rB:s1;s2;s2;d4;s4;s6;s7;s8;s9;d10;s11;d12;d9s13;/rC:;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C11H15NO2 |
All Atoms: | 14 |
Heavy Atoms: | 14 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 7.11222 |
Area: | 387.625 |
Solvation: | -2.57841 |
Coulombic: | -24.2437 |
Bond Count [?]
All: | 14 |
Single: | 10 |
Double: | 4 |
Rotors: | 5 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 193.242 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 3 |
XLogP: | 1.41 |
LogP (Chemaxon): | 1.15 |
Name Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical | Mix Source | External ID | Descriptor | Value |
---|
Experimental Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical Mix | Source | External ID | Descriptor | Value |
---|
Descriptor Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical Mix | Source | External ID | Descriptor | Value |
---|