Chemical ID: 7432296

CN1CCC(C2C1CCCC2)N
Chemical ID:
7432296
Name [?]:
1-methyl-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-4-amine
SMILES [?]:
CN1CCC(C2C1CCCC2)N
InChi [?]:
InChI=1/C10H20N2/c1-12-7-6-9(11)8-4-2-3-5-10(8)12/h8-10H,2-7,11H2,1H3
InChi Info:
AuxInfo=1/0/N:1,10,9,11,8,4,3,6,5,7,12,2/rA:12cCNCCCCCCCCCN/rB:s1;s2;s3;s4;s5;s2s6;s7;s8;s9;s6s10;s5;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H20N2
All Atoms:32
Heavy Atoms:12
Chiral Atoms:4
ZAP Information [?]
Total:6.92045
Area:315.885
Solvation:-0.976663
Coulombic:-17.7948
Bond Count [?]
All:13
Single:13
Double:0
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:168.279
H-Bond Donors:2
H-Bond Acceptors:2
XLogP:1.17
LogP (Chemaxon):0.64

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue