Chemical ID: 7108618

Cc1ccc(cc1)CNC2CCCCCCC2
Chemical ID:
7108618
Name [?]:
N-(p-tolylmethyl)cyclooctanamine
SMILES [?]:
Cc1ccc(cc1)CNC2CCCCCCC2
InChi [?]:
InChI=1/C16H25N/c1-14-9-11-15(12-10-14)13-17-16-7-5-3-2-4-6-8-16/h9-12,16-17H,2-8,13H2,1H3
InChi Info:
AuxInfo=1/0/N:1,14,13,15,12,16,11,17,3,7,4,6,8,2,5,10,9/E:(3,4)(5,6)(7,8)(9,10)(11,12)/rA:17nCCCCCCCCNCCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;s9;s10;s11;s12;s13;s14;s15;s10s16;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H25N
All Atoms:42
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:9.88988
Area:436.455
Solvation:-1.0215
Coulombic:-11.8809
Bond Count [?]
All:18
Single:15
Double:3
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:231.376
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:4.94
LogP (Chemaxon):4.42

Name Annotations

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Descriptor Annotations

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