Chemical ID: 7255242

COc1ccc(cc1)CNC(=O)COc2ccccc2C#N
Chemical ID:
7255242
Name [?]:
2-(2-cyanophenoxy)-N-[(4-methoxyphenyl)methyl]acetamide
SMILES [?]:
COc1ccc(cc1)CNC(=O)COc2ccccc2C#N
InChi [?]:
InChI=1/C17H16N2O3/c1-21-15-8-6-13(7-9-15)11-19-17(20)12-22-16-5-3-2-4-14(16)10-18/h2-9H,11-12H2,1H3,(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,18,17,19,16,5,7,4,8,21,9,13,6,20,3,15,11,22,10,12,2,14/E:(6,7)(8,9)/rA:22nCOCCCCCCCNCOCOCCCCCCCN/rB:s1;s2;s3;d4;s5;d6;d3s7;s6;s9;s10;d11;s11;s13;s14;s15;d16;s17;d18;d15s19;s20;t21;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H16N2O3
All Atoms:38
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:7.27773
Area:530.868
Solvation:-5.99398
Coulombic:-39.6303
Bond Count [?]
All:23
Single:15
Double:7
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:296.321
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:2.46
LogP (Chemaxon):2.06

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Descriptor Annotations

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