Chemical ID: 4122386

CC1CCC(CC1)NCc2ccco2
Chemical ID:
4122386
Name [?]:
N-(2-furylmethyl)-4-methyl-cyclohexan-1-amine
SMILES [?]:
CC1CCC(CC1)NCc2ccco2
InChi [?]:
InChI=1/C12H19NO/c1-10-4-6-11(7-5-10)13-9-12-3-2-8-14-12/h2-3,8,10-11,13H,4-7,9H2,1H3
InChi Info:
AuxInfo=1/0/N:1,12,11,3,7,4,6,13,9,2,5,10,8,14/E:(4,5)(6,7)/rA:14nCCCCCCCNCCCCCO/rB:s1;s2;s3;s4;s5;s2s6;s5;s8;s9;d10;s11;d12;s10s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H19NO
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:7.73205
Area:386.007
Solvation:-1.91812
Coulombic:-16.649
Bond Count [?]
All:15
Single:13
Double:2
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:193.285
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:2.57
LogP (Chemaxon):2.44

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Descriptor Annotations

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