Chemical ID: 5187111

COC1CCC(CC1OC)CCNC(=O)N
Chemical ID:
5187111
Name [?]:
2-(3,4-dimethoxycyclohexyl)ethylurea
SMILES [?]:
COC1CCC(CC1OC)CCNC(=O)N
InChi [?]:
InChI=1/C11H22N2O3/c1-15-9-4-3-8(7-10(9)16-2)5-6-13-11(12)14/h8-10H,3-7H2,1-2H3,(H3,12,13,14)
InChi Info:
AuxInfo=1/1/N:1,10,5,4,11,12,7,6,3,8,14,16,13,15,2,9/rA:16cCOCCCCCCOCCCNCON/rB:s1;s2;s3;s4;s5;s6;s3s7;s8;s9;s6;s11;s12;s13;d14;s14;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H22N2O3
All Atoms:16
Heavy Atoms:16
Chiral Atoms:3
ZAP Information [?]
Total:5.72196
Area:433.336
Solvation:-5.11145
Coulombic:-53.7634
Bond Count [?]
All:16
Single:15
Double:1
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:230.304
H-Bond Donors:3
H-Bond Acceptors:5
XLogP:-0.02
LogP (Chemaxon):-0.1

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