Chemical ID: 4685967

Cc1ccc(cc1)N2CC3Cc4ccccc4CN3C2
Chemical ID:
4685967
Name [?]:
None
SMILES [?]:
Cc1ccc(cc1)N2CC3Cc4ccccc4CN3C2
InChi [?]:
InChI=1/C18H20N2/c1-14-6-8-17(9-7-14)20-12-18-10-15-4-2-3-5-16(15)11-19(18)13-20/h2-9,18H,10-13H2,1H3
InChi Info:
AuxInfo=1/0/N:1,14,15,13,16,3,7,4,6,11,18,9,20,2,12,17,5,10,19,8/E:(6,7)(8,9)/rA:20cCCCCCCCNCCCCCCCCCCNC/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;s9;s10;s11;s12;d13;s14;d15;d12s16;s17;s10s18;s8s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H20N2
All Atoms:20
Heavy Atoms:20
Chiral Atoms:3
ZAP Information [?]
Total:8.92347
Area:448.68
Solvation:-2.29353
Coulombic:-12.9357
Bond Count [?]
All:23
Single:17
Double:6
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:264.365
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:4.04
LogP (Chemaxon):4.78

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