Chemical ID: 4743931

Cc1c(c(c(c(c1C)C)CN2CCCCC2)C)C
Chemical ID:
4743931
Name [?]:
1-[(2,3,4,5,6-pentamethylphenyl)methyl]piperidine
SMILES [?]:
Cc1c(c(c(c(c1C)C)CN2CCCCC2)C)C
InChi [?]:
InChI=1/C17H27N/c1-12-13(2)15(4)17(16(5)14(12)3)11-18-9-7-6-8-10-18/h6-11H2,1-5H3
InChi Info:
AuxInfo=1/0/N:1,8,18,9,17,14,13,15,12,16,10,2,7,3,6,4,5,11/E:(2,3)(4,5)(7,8)(9,10)(13,14)(15,16)/rA:18nCCCCCCCCCCNCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s7;s6;s5;s10;s11;s12;s13;s14;s11s15;s4;s3;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H27N
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:9.61723
Area:433.208
Solvation:-1.21298
Coulombic:-5.78239
Bond Count [?]
All:19
Single:16
Double:3
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:245.403
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:4.82
LogP (Chemaxon):4.99

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Descriptor Annotations

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