Chemical ID: 4284850

c1ccc2c(c1)c3ccccc3nc2NC4CCCCC4
Chemical ID:
4284850
Name [?]:
N-cyclohexylphenanthridin-6-amine
SMILES [?]:
c1ccc2c(c1)c3ccccc3nc2NC4CCCCC4
InChi [?]:
InChI=1/C19H20N2/c1-2-8-14(9-3-1)20-19-17-12-5-4-10-15(17)16-11-6-7-13-18(16)21-19/h4-7,10-14H,1-3,8-9H2,(H,20,21)
InChi Info:
AuxInfo=1/1/N:19,18,20,1,2,9,10,17,21,6,8,3,11,16,5,7,4,12,14,15,13/E:(2,3)(8,9)/rA:21nCCCCCCCCCCCCNCNCCCCCC/rB:s1;d2;s3;s4;d1s5;d5;s7;d8;s9;d10;s7s11;d12;d4s13;s14;s15;s16;s17;s18;s19;s16s20;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H20N2
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:10.3773
Area:469.111
Solvation:-1.35052
Coulombic:-20.7856
Bond Count [?]
All:24
Single:17
Double:7
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:276.376
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:5.59
LogP (Chemaxon):5.0

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