ChemDB: Chemical Search
Download
Chemical ID: 5470994
Chemical ID:
5470994
Name [?]:
N-(4-ethoxy-1-naphthyl)formamide
SMILES [?]:
CCOc1ccc(c2c1cccc2)NC=O
InChi [?]:
InChI=1/C13H13NO2/c1-2-16-13-8-7-12(14-9-15)10-5-3-4-6-11(10)13/h3-9H,2H2,1H3,(H,14,15)
InChi Info:
AuxInfo=1/1/N:1,2,12,11,13,10,6,5,15,8,9,7,4,14,16,3/rA:16nCCOCCCCCCCCCCNCO/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;d10;s11;s8d12;s7;s14;d15;/rC:;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C13H13NO2 |
All Atoms: | 16 |
Heavy Atoms: | 16 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 6.49002 |
Area: | 391.046 |
Solvation: | -3.28614 |
Coulombic: | -27.6382 |
Bond Count [?]
All: | 17 |
Single: | 11 |
Double: | 6 |
Rotors: | 4 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 215.248 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 3 |
XLogP: | 2.64 |
LogP (Chemaxon): | 2.36 |
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 |
---|