Chemical ID: 7177767

Cc1ccc(c(c1)CC2CCNCC2)C
Chemical ID:
7177767
Name [?]:
4-[(2,5-dimethylphenyl)methyl]piperidine
SMILES [?]:
Cc1ccc(c(c1)CC2CCNCC2)C
InChi [?]:
InChI=1/C14H21N/c1-11-3-4-12(2)14(9-11)10-13-5-7-15-8-6-13/h3-4,9,13,15H,5-8,10H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,15,3,4,10,14,11,13,7,8,2,5,9,6,12/E:(5,6)(7,8)/rA:15nCCCCCCCCCCCNCCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;s9;s10;s11;s12;s9s13;s5;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H21N
All Atoms:36
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:8.69063
Area:388.218
Solvation:-1.01481
Coulombic:-10.4897
Bond Count [?]
All:16
Single:13
Double:3
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:203.323
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:3.51
LogP (Chemaxon):3.4

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Descriptor Annotations

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