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Chemical ID: 7109445
Chemical ID:
7109445
Name [?]:
N-(2-pyridylmethyl)hexan-1-amine
SMILES [?]:
CCCCCCNCc1ccccn1
InChi [?]:
InChI=1/C12H20N2/c1-2-3-4-6-9-13-11-12-8-5-7-10-14-12/h5,7-8,10,13H,2-4,6,9,11H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,3,4,11,5,12,10,6,13,8,9,7,14/rA:14nCCCCCCNCCCCCCN/rB:s1;s2;s3;s4;s5;s6;s7;s8;s9;d10;s11;d12;d9s13;/rC:;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C12H20N2 |
All Atoms: | 34 |
Heavy Atoms: | 14 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 8.96152 |
Area: | 420.497 |
Solvation: | -1.55091 |
Coulombic: | -15.2467 |
Bond Count [?]
All: | 14 |
Single: | 11 |
Double: | 3 |
Rotors: | 7 |
Chiral: | 0 |
Rigid Segments: | 5 |
Chemical Properties
Molecular Weight: | 192.301 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 1 |
XLogP: | 2.86 |
LogP (Chemaxon): | 2.41 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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