Chemical ID: 7514275

CC1CCN(CC1)CCCCOc2ccccc2Cl
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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