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Chemical ID: 5079733
Chemical ID:
5079733
Name [?]:
N-[4-(5-phenylpentyl)phenyl]acetamide
SMILES [?]:
CC(=O)Nc1ccc(cc1)CCCCCc2ccccc2
InChi [?]:
InChI=1/C19H23NO/c1-16(21)20-19-14-12-18(13-15-19)11-7-3-6-10-17-8-4-2-5-9-17/h2,4-5,8-9,12-15H,3,6-7,10-11H2,1H3,(H,20,21)
InChi Info:
AuxInfo=1/1/N:1,19,13,18,20,14,12,17,21,15,11,7,9,6,10,2,16,8,5,4,3/E:(4,5)(8,9)(12,13)(14,15)/rA:21nCCONCCCCCCCCCCCCCCCCC/rB:s1;d2;s2;s4;s5;d6;s7;d8;d5s9;s8;s11;s12;s13;s14;s15;s16;d17;s18;d19;d16s20;/rC:;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C19H23NO |
All Atoms: | 21 |
Heavy Atoms: | 21 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 10.9856 |
Area: | 533.331 |
Solvation: | -2.34768 |
Coulombic: | -22.6152 |
Bond Count [?]
All: | 22 |
Single: | 15 |
Double: | 7 |
Rotors: | 8 |
Chiral: | 0 |
Rigid Segments: | 5 |
Chemical Properties
Molecular Weight: | 281.392 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 2 |
XLogP: | 5.33 |
LogP (Chemaxon): | 5.04 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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