Chemical ID: 7109464

c1ccnc(c1)CNC2CCCCCCC2
Chemical ID:
7109464
Name [?]:
N-(2-pyridylmethyl)cyclooctanamine
SMILES [?]:
c1ccnc(c1)CNC2CCCCCCC2
InChi [?]:
InChI=1/C14H22N2/c1-2-4-8-13(9-5-3-1)16-12-14-10-6-7-11-15-14/h6-7,10-11,13,16H,1-5,8-9,12H2
InChi Info:
AuxInfo=1/0/N:13,12,14,11,15,1,2,10,16,6,3,7,9,5,4,8/E:(2,3)(4,5)(8,9)/rA:16nCCCNCCCNCCCCCCCC/rB:s1;d2;s3;d4;d1s5;s5;s7;s8;s9;s10;s11;s12;s13;s14;s9s15;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H22N2
All Atoms:38
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:8.51423
Area:412.294
Solvation:-1.79312
Coulombic:-15.0135
Bond Count [?]
All:17
Single:14
Double:3
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:218.338
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:3.34
LogP (Chemaxon):2.79

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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