ChemDB: Chemical Search
Download
Chemical ID: 6658992
Chemical ID:
6658992
Name [?]:
N-methyl-N-(1-methyl-2-phenyl-ethyl)-acetamide
SMILES [?]:
CC(Cc1ccccc1)N(C)C(=O)C
InChi [?]:
InChI=1/C12H17NO/c1-10(13(3)11(2)14)9-12-7-5-4-6-8-12/h4-8,10H,9H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,14,11,7,6,8,5,9,3,2,12,4,10,13/E:(5,6)(7,8)/rA:14cCCCCCCCCCNCCOC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s2;s10;s10;d12;s12;/rC:;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C12H17NO |
All Atoms: | 14 |
Heavy Atoms: | 14 |
Chiral Atoms: | 1 |
ZAP Information [?]
Total: | 6.92038 |
Area: | 365.146 |
Solvation: | -2.20828 |
Coulombic: | -16.3763 |
Bond Count [?]
All: | 14 |
Single: | 10 |
Double: | 4 |
Rotors: | 4 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 191.27 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 2 |
XLogP: | 2.18 |
LogP (Chemaxon): | 1.9 |
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 |
---|