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Chemical ID: 7514275
Chemical ID:
7514275
Name [?]:
1-[4-(2-chlorophenoxy)butyl]-4-methyl-piperidine
SMILES [?]:
CC1CCN(CC1)CCCCOc2ccccc2Cl
InChi [?]:
InChI=1/C16H24ClNO/c1-14-8-11-18(12-9-14)10-4-5-13-19-16-7-3-2-6-15(16)17/h2-3,6-7,14H,4-5,8-13H2,1H3
InChi Info:
AuxInfo=1/0/N:1,16,15,9,10,17,14,3,7,8,4,6,11,2,18,13,19,5,12/E:(8,9)(11,12)/rA:19nCCCCNCCCCCCOCCCCCCCl/rB:s1;s2;s3;s4;s5;s2s6;s5;s8;s9;s10;s11;s12;s13;d14;s15;d16;d13s17;s18;/rC:;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C16H24ClNO |
All Atoms: | 43 |
Heavy Atoms: | 19 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 10.2751 |
Area: | 505.942 |
Solvation: | -2.37342 |
Coulombic: | -14.9878 |
Bond Count [?]
All: | 20 |
Single: | 17 |
Double: | 3 |
Rotors: | 6 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 4.5 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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