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Chemical ID: 4665351
Chemical ID:
4665351
Name [?]:
N-(4-phenylcyclohexyl)acetamide
SMILES [?]:
CC(=O)NC1CCC(CC1)c2ccccc2
InChi [?]:
InChI=1/C14H19NO/c1-11(16)15-14-9-7-13(8-10-14)12-5-3-2-4-6-12/h2-6,13-14H,7-10H2,1H3,(H,15,16)
InChi Info:
AuxInfo=1/1/N:1,14,13,15,12,16,7,9,6,10,2,11,8,5,4,3/E:(3,4)(5,6)(7,8)(9,10)/rA:16nCCONCCCCCCCCCCCC/rB:s1;d2;s2;s4;s5;s6;s7;s8;s5s9;s8;s11;d12;s13;d14;d11s15;/rC:;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C14H19NO |
All Atoms: | 16 |
Heavy Atoms: | 16 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 8.36965 |
Area: | 412.309 |
Solvation: | -1.93807 |
Coulombic: | -21.9624 |
Bond Count [?]
All: | 17 |
Single: | 13 |
Double: | 4 |
Rotors: | 3 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 217.307 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 2 |
XLogP: | 2.92 |
LogP (Chemaxon): | 2.35 |
Name Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
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Experimental Annotations
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Descriptor Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
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