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Chemical ID: 4087106
Chemical ID:
4087106
Name [?]:
N-(4-acetamidophenyl)-2-methoxy-benzamide
SMILES [?]:
CC(=O)Nc1ccc(cc1)NC(=O)c2ccccc2OC
InChi [?]:
InChI=1/C16H16N2O3/c1-11(19)17-12-7-9-13(10-8-12)18-16(20)14-5-3-4-6-15(14)21-2/h3-10H,1-2H3,(H,17,19)(H,18,20)
InChi Info:
AuxInfo=1/1/N:1,21,16,17,15,18,6,10,7,9,2,5,8,14,19,12,4,11,3,13,20/E:(7,8)(9,10)/rA:21nCCONCCCCCCNCOCCCCCCOC/rB:s1;d2;s2;s4;s5;d6;s7;d8;d5s9;s8;s11;d12;s12;s14;d15;s16;d17;d14s18;s19;s20;/rC:;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C16H16N2O3 |
All Atoms: | 21 |
Heavy Atoms: | 21 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 6.91104 |
Area: | 484.958 |
Solvation: | -5.21292 |
Coulombic: | -46.6325 |
Bond Count [?]
All: | 22 |
Single: | 14 |
Double: | 8 |
Rotors: | 6 |
Chiral: | 0 |
Rigid Segments: | 5 |
Chemical Properties
Molecular Weight: | 284.31 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 5 |
XLogP: | 1.74 |
LogP (Chemaxon): | 2.18 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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