Chemical ID: 6359476

C1CCC(CC1)NC(=O)NC2CCCC2
Chemical ID:
6359476
Name [?]:
1-cyclohexyl-3-cyclopentyl-urea
SMILES [?]:
C1CCC(CC1)NC(=O)NC2CCCC2
InChi [?]:
InChI=1/C12H22N2O/c15-12(14-11-8-4-5-9-11)13-10-6-2-1-3-7-10/h10-11H,1-9H2,(H2,13,14,15)
InChi Info:
AuxInfo=1/1/N:1,2,6,13,14,3,5,12,15,4,11,8,7,10,9/E:(2,3)(4,5)(6,7)(8,9)/rA:15nCCCCCCNCONCCCCC/rB:s1;s2;s3;s4;s1s5;s4;s7;d8;s8;s10;s11;s12;s13;s11s14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H22N2O
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:8.76449
Area:401.368
Solvation:-1.26972
Coulombic:-36.1908
Bond Count [?]
All:16
Single:15
Double:1
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:210.316
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:2.44
LogP (Chemaxon):1.96

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