Chemical ID: 3967604

C1CCC(CC1)NC(=O)NC2CCCCC2
Chemical ID:
3967604
Name [?]:
1,3-dicyclohexylurea
SMILES [?]:
C1CCC(CC1)NC(=O)NC2CCCCC2
InChi [?]:
InChI=1/C13H24N2O/c16-13(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h11-12H,1-10H2,(H2,14,15,16)
InChi Info:
AuxInfo=1/1/N:1,14,2,6,13,15,3,5,12,16,4,11,8,7,10,9/E:(1,2)(3,4,5,6)(7,8,9,10)(11,12)(14,15)/rA:16nCCCCCCNCONCCCCCC/rB:s1;s2;s3;s4;s1s5;s4;s7;d8;s8;s10;s11;s12;s13;s14;s11s15;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H24N2O
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:9.16898
Area:418.02
Solvation:-1.28152
Coulombic:-36.522
Bond Count [?]
All:17
Single:16
Double:1
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:224.343
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:3.01
LogP (Chemaxon):2.36

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Descriptor Annotations

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