ChemDB: Chemical Search
Download
Chemical ID: 5783762
Chemical ID:
5783762
Name [?]:
N-(2,2-diphenylethyl)acetamide
SMILES [?]:
CC(=O)NCC(c1ccccc1)c2ccccc2
InChi [?]:
InChI=1/C16H17NO/c1-13(18)17-12-16(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,16H,12H2,1H3,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,10,16,9,11,15,17,8,12,14,18,5,2,7,13,6,4,3/E:(2,3)(4,5,6,7)(8,9,10,11)(14,15)/rA:18nCCONCCCCCCCCCCCCCC/rB:s1;d2;s2;s4;s5;s6;s7;d8;s9;d10;d7s11;s6;s13;d14;s15;d16;d13s17;/rC:;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C16H17NO |
All Atoms: | 18 |
Heavy Atoms: | 18 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 8.79087 |
Area: | 444.644 |
Solvation: | -2.32523 |
Coulombic: | -23.193 |
Bond Count [?]
All: | 19 |
Single: | 12 |
Double: | 7 |
Rotors: | 5 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 239.312 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 2 |
XLogP: | 3.07 |
LogP (Chemaxon): | 2.86 |
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 |
---|