ChemDB: Chemical Search
Download
Chemical ID: 5306336
Chemical ID:
5306336
Name [?]:
N-(1,5,7-trimethyl-2-oxo-indolin-3-yl)acetamide
SMILES [?]:
Cc1cc(c2c(c1)C(C(=O)N2C)NC(=O)C)C
InChi [?]:
InChI=1/C13H16N2O2/c1-7-5-8(2)12-10(6-7)11(14-9(3)16)13(17)15(12)4/h5-6,11H,1-4H3,(H,14,16)
InChi Info:
AuxInfo=1/1/N:1,17,16,12,3,7,2,4,14,6,8,5,9,13,11,15,10/rA:17cCCCCCCCCCONCNCOCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;d9;s5s9;s11;s8;s13;d14;s14;s4;/rC:;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C13H16N2O2 |
All Atoms: | 17 |
Heavy Atoms: | 17 |
Chiral Atoms: | 1 |
ZAP Information [?]
Total: | 7.11749 |
Area: | 408.753 |
Solvation: | -3.10134 |
Coulombic: | -36.0556 |
Bond Count [?]
All: | 18 |
Single: | 13 |
Double: | 5 |
Rotors: | 2 |
Chiral: | 0 |
Rigid Segments: | 2 |
Chemical Properties
Molecular Weight: | 232.278 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 4 |
XLogP: | 1.24 |
LogP (Chemaxon): | 0.92 |
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 |
---|