Chemical ID: 5174582

CCC1CCC(CC1)NC(=O)NC
Chemical ID:
5174582
Name [?]:
1-(4-ethylcyclohexyl)-3-methyl-urea
SMILES [?]:
CCC1CCC(CC1)NC(=O)NC
InChi [?]:
InChI=1/C10H20N2O/c1-3-8-4-6-9(7-5-8)12-10(13)11-2/h8-9H,3-7H2,1-2H3,(H2,11,12,13)
InChi Info:
AuxInfo=1/1/N:1,13,2,4,8,5,7,3,6,10,12,9,11/E:(4,5)(6,7)/rA:13nCCCCCCCCNCONC/rB:s1;s2;s3;s4;s5;s6;s3s7;s6;s9;d10;s10;s12;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H20N2O
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:7.98532
Area:372.282
Solvation:-1.32173
Coulombic:-35.966
Bond Count [?]
All:13
Single:12
Double:1
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:184.279
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:2.26
LogP (Chemaxon):1.5

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Descriptor Annotations

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