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Chemical ID: 6677572
Chemical ID:
6677572
Name [?]:
N-(4-acetamido-3-methoxy-phenyl)-2,2-dimethyl-propanamide
SMILES [?]:
CC(=O)Nc1ccc(cc1OC)NC(=O)C(C)(C)C
InChi [?]:
InChI=1/C14H20N2O3/c1-9(17)15-11-7-6-10(8-12(11)19-5)16-13(18)14(2,3)4/h6-8H,1-5H3,(H,15,17)(H,16,18)
InChi Info:
AuxInfo=1/1/N:1,17,18,19,12,7,6,9,2,8,5,10,14,16,4,13,3,15,11/E:(2,3,4)/rA:19nCCONCCCCCCOCNCOCCCC/rB:s1;d2;s2;s4;s5;d6;s7;d8;d5s9;s10;s11;s8;s13;d14;s14;s16;s16;s16;/rC:;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C14H20N2O3 |
All Atoms: | 19 |
Heavy Atoms: | 19 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 7.6442 |
Area: | 466.413 |
Solvation: | -4.01613 |
Coulombic: | -46.7178 |
Bond Count [?]
All: | 19 |
Single: | 14 |
Double: | 5 |
Rotors: | 6 |
Chiral: | 0 |
Rigid Segments: | 5 |
Chemical Properties
Molecular Weight: | 264.32 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 5 |
XLogP: | 0.77 |
LogP (Chemaxon): | 2.3 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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